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Patent code US10266496

Compile Data Set for Download or QSAR
Found 196 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377695
PNG
(US10266496, Example 7)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2cc[nH]c12)C#N
Show InChI InChI=1S/C16H10N2O3/c17-8-9-5-11-3-4-18-15(11)13(6-9)10-1-2-12(16(20)21)14(19)7-10/h1-7,18-19H,(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 10.9n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377700
PNG
(US10266496, Example 27)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2oc(Cl)cc12)C#N
Show InChI InChI=1S/C16H8ClNO4/c17-15-6-12-11(3-8(7-18)4-14(12)22-15)9-1-2-10(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 14n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377703
PNG
(US10266496, Example 30)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2sc(F)cc12)C#N
Show InChI InChI=1S/C16H8FNO3S/c17-15-6-12-11(3-8(7-18)4-14(12)22-15)9-1-2-10(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 15n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377690
PNG
(US10266496, Example 2)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2ccccc12)C#N
Show InChI InChI=1S/C18H11NO3/c19-10-11-7-12-3-1-2-4-14(12)16(8-11)13-5-6-15(18(21)22)17(20)9-13/h1-9,20H,(H,21,22)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 19n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377689
PNG
(US10266496, Example 1)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2ccoc12)C#N
Show InChI InChI=1S/C16H9NO4/c17-8-9-5-11-3-4-21-15(11)13(6-9)10-1-2-12(16(19)20)14(18)7-10/h1-7,18H,(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 19.6n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377706
PNG
(US10266496, Example 40)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2cc(Cl)oc12)C#N
Show InChI InChI=1S/C16H8ClNO4/c17-14-6-10-3-8(7-18)4-12(15(10)22-14)9-1-2-11(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 30n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377701
PNG
(US10266496, Example 28)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2oc(F)cc12)C#N
Show InChI InChI=1S/C16H8FNO4/c17-15-6-12-11(3-8(7-18)4-14(12)22-15)9-1-2-10(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
KEGG

UniProtKB/SwissProt

DrugBank
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PC cid
PC sid
UniChem
US Patent
n/an/a 34n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377702
PNG
(US10266496, Example 29)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2cc(F)oc12)C#N
Show InChI InChI=1S/C16H8FNO4/c17-14-6-10-3-8(7-18)4-12(15(10)22-14)9-1-2-11(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 34.6n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377702
PNG
(US10266496, Example 29)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2cc(F)oc12)C#N
Show InChI InChI=1S/C16H8FNO4/c17-14-6-10-3-8(7-18)4-12(15(10)22-14)9-1-2-11(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
KEGG

UniProtKB/SwissProt

DrugBank
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PC cid
PC sid
UniChem
US Patent
n/an/a 38n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377698
PNG
(US10266496, Example 21)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2occc12)C#N
Show InChI InChI=1S/C16H9NO4/c17-8-9-5-13(11-3-4-21-15(11)6-9)10-1-2-12(16(19)20)14(18)7-10/h1-7,18H,(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 39.5n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377704
PNG
(US10266496, Example 31)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2sccc12)C#N
Show InChI InChI=1S/C16H9NO3S/c17-8-9-5-13(11-3-4-21-15(11)6-9)10-1-2-12(16(19)20)14(18)7-10/h1-7,18H,(H,19,20)
KEGG

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UniChem
US Patent
n/an/a 45n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377706
PNG
(US10266496, Example 40)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2cc(Cl)oc12)C#N
Show InChI InChI=1S/C16H8ClNO4/c17-14-6-10-3-8(7-18)4-12(15(10)22-14)9-1-2-11(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 53.6n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377661
PNG
(4-[({6-chloro-7-[(2-methylpyridin-4-yl)methoxy]-2-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4ccnc(C)c4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H21ClN4O3/c1-15-7-16(5-6-28-15)14-33-24-11-22-18(9-21(24)26)8-19(25(31)30-22)13-29-20-4-3-17(12-27)23(10-20)32-2/h3-11,29H,13-14H2,1-2H3,(H,30,31)
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377666
PNG
(4-[({6-chloro-7-[(1-methyl-1H-imidazol-2- | US1026...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4nccn4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C23H20ClN5O3/c1-29-6-5-26-22(29)13-32-21-10-19-15(8-18(21)24)7-16(23(30)28-19)12-27-17-4-3-14(11-25)20(9-17)31-2/h3-10,27H,12-13H2,1-2H3,(H,28,30)
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377675
PNG
(4-[({6-chloro-2-oxo-7-[2-(piperidin-1-yl)ethoxy]-1...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCCCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H27ClN4O3/c1-32-23-13-20(6-5-17(23)15-27)28-16-19-11-18-12-21(26)24(14-22(18)29-25(19)31)33-10-9-30-7-3-2-4-8-30/h5-6,11-14,28H,2-4,7-10,16H2,1H3,(H,29,31)
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377521
PNG
(4-{[1-(6-chloro-2-oxo-1,2- | US10266495, Compound ...)
Show SMILES COc1cc(NC(C)c2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C19H16ClN3O2/c1-11(22-15-5-3-12(10-21)18(9-15)25-2)16-8-13-7-14(20)4-6-17(13)23-19(16)24/h3-9,11,22H,1-2H3,(H,23,24)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377650
PNG
(4-({[6-chloro-2-oxo-7-(pyridin-3-ylmethoxy)-1,2- |...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4cccnc4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H19ClN4O3/c1-31-22-9-19(5-4-16(22)11-26)28-13-18-7-17-8-20(25)23(10-21(17)29-24(18)30)32-14-15-3-2-6-27-12-15/h2-10,12,28H,13-14H2,1H3,(H,29,30)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377651
PNG
(4-({[6-chloro-7-(oxan-4-ylmethoxy)-2-oxo-1,2- | US...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC4CCOCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H24ClN3O4/c1-30-22-10-19(3-2-16(22)12-26)27-13-18-8-17-9-20(25)23(11-21(17)28-24(18)29)32-14-15-4-6-31-7-5-15/h2-3,8-11,15,27H,4-7,13-14H2,1H3,(H,28,29)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377667
PNG
(5-{[(6-chloro-3-{[(4-cyano-3- | US10266495, Compou...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4nc(no4)C(N)=O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C22H17ClN6O5/c1-32-17-6-14(3-2-11(17)8-24)26-9-13-4-12-5-15(23)18(7-16(12)27-22(13)31)33-10-19-28-21(20(25)30)29-34-19/h2-7,26H,9-10H2,1H3,(H2,25,30)(H,27,31)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377669
PNG
(4-[({6-chloro-2-oxo-7-[2-(pyridin-4-yl)ethoxy]-1,2...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCc4ccncc4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H21ClN4O3/c1-32-23-12-20(3-2-17(23)14-27)29-15-19-10-18-11-21(26)24(13-22(18)30-25(19)31)33-9-6-16-4-7-28-8-5-16/h2-5,7-8,10-13,29H,6,9,15H2,1H3,(H,30,31)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377521
PNG
(4-{[1-(6-chloro-2-oxo-1,2- | US10266495, Compound ...)
Show SMILES COc1cc(NC(C)c2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C19H16ClN3O2/c1-11(22-15-5-3-12(10-21)18(9-15)25-2)16-8-13-7-14(20)4-6-17(13)23-19(16)24/h3-9,11,22H,1-2H3,(H,23,24)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377668
PNG
(4-[({6-chloro-2-oxo-7-[2-(pyridin-2-yl)ethoxy]-1,2...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCc4ccccn4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H21ClN4O3/c1-32-23-12-20(6-5-16(23)14-27)29-15-18-10-17-11-21(26)24(13-22(17)30-25(18)31)33-9-7-19-4-2-3-8-28-19/h2-6,8,10-13,29H,7,9,15H2,1H3,(H,30,31)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377676
PNG
(4-[({6-chloro-7-[2-(4-methylpiperazin-1-yl)ethoxy]...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCN(C)CC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H28ClN5O3/c1-30-5-7-31(8-6-30)9-10-34-24-14-22-18(12-21(24)26)11-19(25(32)29-22)16-28-20-4-3-17(15-27)23(13-20)33-2/h3-4,11-14,28H,5-10,16H2,1-2H3,(H,29,32)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377686
PNG
(4-({[6-chloro-2-oxo-8- | US10266495, Compound I-98)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(OCc4ccccn4)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H19ClN4O3/c1-31-21-11-19(6-5-15(21)12-26)28-13-17-8-16-9-18(25)10-22(23(16)29-24(17)30)32-14-20-4-2-3-7-27-20/h2-11,28H,13-14H2,1H3,(H,29,30)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377660
PNG
(4-[({6-chloro-7-[(1-methylpiperidin-2-yl)methoxy]-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC4CCCCN4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C25H27ClN4O3/c1-30-8-4-3-5-20(30)15-33-24-12-22-17(10-21(24)26)9-18(25(31)29-22)14-28-19-7-6-16(13-27)23(11-19)32-2/h6-7,9-12,20,28H,3-5,8,14-15H2,1-2H3,(H,29,31)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377658
PNG
(4-[({6-chloro-7-[(1,5-dimethyl-1H-pyrazol-3- | US1...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4cc(C)n(C)n4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H22ClN5O3/c1-14-6-19(29-30(14)2)13-33-23-10-21-16(8-20(23)25)7-17(24(31)28-21)12-27-18-5-4-15(11-26)22(9-18)32-3/h4-10,27H,12-13H2,1-3H3,(H,28,31)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377614
PNG
(4-{[(6-fluoro-7-methoxy-2-oxo- | US10266495, Compo...)
Show SMILES COc1cc2[nH]c(=O)c(CNc3ccc(C#N)c(OC)c3)cc2cc1F
Show InChI InChI=1S/C19H16FN3O3/c1-25-17-7-14(4-3-11(17)9-21)22-10-13-5-12-6-15(20)18(26-2)8-16(12)23-19(13)24/h3-8,22H,10H2,1-2H3,(H,23,24)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377612
PNG
(4-{[(6-tert-butyl-2-oxo-1,2- | US10266495, Compoun...)
Show SMILES COc1cc(NCc2cc3cc(ccc3[nH]c2=O)C(C)(C)C)ccc1C#N
Show InChI InChI=1S/C22H23N3O2/c1-22(2,3)17-6-8-19-15(10-17)9-16(21(26)25-19)13-24-18-7-5-14(12-23)20(11-18)27-4/h5-11,24H,13H2,1-4H3,(H,25,26)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377611
PNG
(4-{[(6-bromo-2-oxo-1,2- | US10266495, Compound I-2...)
Show SMILES COc1cc(NCc2cc3cc(Br)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14BrN3O2/c1-24-17-8-15(4-2-11(17)9-20)21-10-13-6-12-7-14(19)3-5-16(12)22-18(13)23/h2-8,21H,10H2,1H3,(H,22,23)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377574
PNG
(4-{[(1S)-1-(6-chloro-2-oxo- | US10266495, Compound...)
Show SMILES COc1cc(N[C@@H](C)c2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C19H16ClN3O2/c1-11(22-15-5-3-12(10-21)18(9-15)25-2)16-8-13-7-14(20)4-6-17(13)23-19(16)24/h3-9,11,22H,1-2H3,(H,23,24)/t11-/s2
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377678
PNG
(4-[({6-chloro-7-[2-(2-methyl-1H-imidazol-1- | US10...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCn4ccnc4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H22ClN5O3/c1-15-27-5-6-30(15)7-8-33-23-12-21-17(10-20(23)25)9-18(24(31)29-21)14-28-19-4-3-16(13-26)22(11-19)32-2/h3-6,9-12,28H,7-8,14H2,1-2H3,(H,29,31)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377665
PNG
(4-[({6-chloro-7-[(1-methyl-1H-imidazol-5- | US1026...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4cncn4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C23H20ClN5O3/c1-29-13-26-11-18(29)12-32-22-8-20-15(6-19(22)24)5-16(23(30)28-20)10-27-17-4-3-14(9-25)21(7-17)31-2/h3-8,11,13,27H,10,12H2,1-2H3,(H,28,30)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377664
PNG
(4-({[6-chloro-2-oxo-7-(pyrazin-2-ylmethoxy)-1,2- |...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4cnccn4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C23H18ClN5O3/c1-31-21-8-17(3-2-14(21)10-25)28-11-16-6-15-7-19(24)22(9-20(15)29-23(16)30)32-13-18-12-26-4-5-27-18/h2-9,12,28H,11,13H2,1H3,(H,29,30)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377653
PNG
(4-[({6-chloro-2-oxo-7-[(3S)-oxolan-3-ylmethoxy]-1,...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OC[C@H]4CCOC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C23H22ClN3O4/c1-29-21-8-18(3-2-15(21)10-25)26-11-17-6-16-7-19(24)22(9-20(16)27-23(17)28)31-13-14-4-5-30-12-14/h2-3,6-9,14,26H,4-5,11-13H2,1H3,(H,27,28)/t14-/s2
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377657
PNG
(4-[({6-chloro-7-[2-(morpholin-4-yl)-2-oxoethoxy]-2...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC(=O)N4CCOCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H23ClN4O5/c1-32-21-10-18(3-2-15(21)12-26)27-13-17-8-16-9-19(25)22(11-20(16)28-24(17)31)34-14-23(30)29-4-6-33-7-5-29/h2-3,8-11,27H,4-7,13-14H2,1H3,(H,28,31)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377646
PNG
(4-({[6-chloro-2-oxo-7-(pyridin-2-ylmethoxy)-1,2- |...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4ccccn4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H19ClN4O3/c1-31-22-10-18(6-5-15(22)12-26)28-13-17-8-16-9-20(25)23(11-21(16)29-24(17)30)32-14-19-4-2-3-7-27-19/h2-11,28H,13-14H2,1H3,(H,29,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377654
PNG
(4-[({6-chloro-7-[(1-methylpiperidin-4-yl)oxy]-2-ox...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OC4CCN(C)CC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O3/c1-29-7-5-19(6-8-29)32-23-12-21-16(10-20(23)25)9-17(24(30)28-21)14-27-18-4-3-15(13-26)22(11-18)31-2/h3-4,9-12,19,27H,5-8,14H2,1-2H3,(H,28,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377671
PNG
(4-[({6-chloro-2-oxo-7-[3-(pyrrolidin-1-yl)propoxy]...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCCN4CCCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H27ClN4O3/c1-32-23-13-20(6-5-17(23)15-27)28-16-19-11-18-12-21(26)24(14-22(18)29-25(19)31)33-10-4-9-30-7-2-3-8-30/h5-6,11-14,28H,2-4,7-10,16H2,1H3,(H,29,31)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377659
PNG
(4-({[7-(benzyloxy)-6-chloro-2-oxo-1,2- | US1026649...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4ccccc4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H20ClN3O3/c1-31-23-11-20(8-7-17(23)13-27)28-14-19-9-18-10-21(26)24(12-22(18)29-25(19)30)32-15-16-5-3-2-4-6-16/h2-12,28H,14-15H2,1H3,(H,29,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377656
PNG
(2-[(6-chloro-3-{[(4-cyano-3- | US10266495, Compoun...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC(N)=O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C20H17ClN4O4/c1-28-17-6-14(3-2-11(17)8-22)24-9-13-4-12-5-15(21)18(29-10-19(23)26)7-16(12)25-20(13)27/h2-7,24H,9-10H2,1H3,(H2,23,26)(H,25,27)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377648
PNG
(4-[({6-chloro-7-[2-(morpholin-4-yl)ethoxy]-2-oxo-1...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCOCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O4/c1-31-22-12-19(3-2-16(22)14-26)27-15-18-10-17-11-20(25)23(13-21(17)28-24(18)30)33-9-6-29-4-7-32-8-5-29/h2-3,10-13,27H,4-9,15H2,1H3,(H,28,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377593
PNG
(4-({1-[6-chloro-2-oxo-7- | US10266495, Compound I-...)
Show SMILES COc1cc(NC(C)c2cc3cc(Cl)c(OCc4ccccn4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C25H21ClN4O3/c1-15(29-18-7-6-16(13-27)23(11-18)32-2)20-9-17-10-21(26)24(12-22(17)30-25(20)31)33-14-19-5-3-4-8-28-19/h3-12,15,29H,14H2,1-2H3,(H,30,31)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377677
PNG
(4-[({6-chloro-7-[2-(1H-imidazol-1-yl)ethoxy]-2-oxo...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCn4ccnc4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C23H20ClN5O3/c1-31-21-10-18(3-2-15(21)12-25)27-13-17-8-16-9-19(24)22(11-20(16)28-23(17)30)32-7-6-29-5-4-26-14-29/h2-5,8-11,14,27H,6-7,13H2,1H3,(H,28,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377674
PNG
(4-[({6-chloro-2-oxo-7-[2-(2-oxopyrrolidin-1- | US1...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCCC4=O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H23ClN4O4/c1-32-21-11-18(5-4-15(21)13-26)27-14-17-9-16-10-19(25)22(12-20(16)28-24(17)31)33-8-7-29-6-2-3-23(29)30/h4-5,9-12,27H,2-3,6-8,14H2,1H3,(H,28,31)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377649
PNG
(4-[({6-chloro-7-[2-(dimethylamino)ethoxy]-2-oxo-1,...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN(C)C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C22H23ClN4O3/c1-27(2)6-7-30-21-11-19-15(9-18(21)23)8-16(22(28)26-19)13-25-17-5-4-14(12-24)20(10-17)29-3/h4-5,8-11,25H,6-7,13H2,1-3H3,(H,26,28)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377613
PNG
(2-methoxy-4-({[2-oxo-6- | US10266495, Compound I-2...)
Show SMILES COc1cc(NCc2cc3cc(ccc3[nH]c2=O)C(F)(F)F)ccc1C#N
Show InChI InChI=1S/C19H14F3N3O2/c1-27-17-8-15(4-2-11(17)9-23)24-10-13-6-12-7-14(19(20,21)22)3-5-16(12)25-18(13)26/h2-8,24H,10H2,1H3,(H,25,26)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377645
PNG
(4-{[(6-chloro-7-hydroxy-2-oxo-1,2-dihydroquinolin-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14ClN3O3/c1-25-17-6-13(3-2-10(17)8-20)21-9-12-4-11-5-14(19)16(23)7-15(11)22-18(12)24/h2-7,21,23H,9H2,1H3,(H,22,24)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377652
PNG
(4-[({6-chloro-7-[2-(4-methanesulfonylpiperazin-1- ...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCN(CC4)S(C)(=O)=O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H28ClN5O5S/c1-35-23-13-20(4-3-17(23)15-27)28-16-19-11-18-12-21(26)24(14-22(18)29-25(19)32)36-10-9-30-5-7-31(8-6-30)37(2,33)34/h3-4,11-14,28H,5-10,16H2,1-2H3,(H,29,32)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377655
PNG
(2-[(6-chloro-3-{[(4-cyano-3- | US10266495, Compoun...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC(=O)N(C)C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C22H21ClN4O4/c1-27(2)21(28)12-31-20-9-18-14(7-17(20)23)6-15(22(29)26-18)11-25-16-5-4-13(10-24)19(8-16)30-3/h4-9,25H,11-12H2,1-3H3,(H,26,29)
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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377682
PNG
(4-{[(6-chloro-7-{[(2S)-1-methylpyrrolidin-2- | US1...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OC[C@@H]4CCCN4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C24H25ClN4O3/c1-29-7-3-4-19(29)14-32-23-11-21-16(9-20(23)25)8-17(24(30)28-21)13-27-18-6-5-15(12-26)22(10-18)31-2/h5-6,8-11,19,27H,3-4,7,13-14H2,1-2H3,(H,28,30)/t19-/s2
PDB

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n/an/a 55n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377704
PNG
(US10266496, Example 31)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2sccc12)C#N
Show InChI InChI=1S/C16H9NO3S/c17-8-9-5-13(11-3-4-21-15(11)6-9)10-1-2-12(16(19)20)14(18)7-10/h1-7,18H,(H,19,20)
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n/an/a 57.8n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377692
PNG
(US10266496, Example 4)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2CCOc12)C#N
Show InChI InChI=1S/C16H11NO4/c17-8-9-5-11-3-4-21-15(11)13(6-9)10-1-2-12(16(19)20)14(18)7-10/h1-2,5-7,18H,3-4H2,(H,19,20)
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n/an/a 60.4n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377697
PNG
(US10266496, Example 18)
Show SMILES Cc1cc2c(cc(cc2o1)C#N)-c1ccc(C(O)=O)c(O)c1
Show InChI InChI=1S/C17H11NO4/c1-9-4-14-13(5-10(8-18)6-16(14)22-9)11-2-3-12(17(20)21)15(19)7-11/h2-7,19H,1H3,(H,20,21)
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n/an/a 63.3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377694
PNG
(US10266496, Example 6)
Show SMILES Cn1c(cc2c(cc(cc12)C#N)-c1ccc(C(O)=O)c(O)c1)C(F)(F)F
Show InChI InChI=1S/C18H11F3N2O3/c1-23-14-5-9(8-22)4-12(13(14)7-16(23)18(19,20)21)10-2-3-11(17(25)26)15(24)6-10/h2-7,24H,1H3,(H,25,26)
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n/an/a 66.2n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377699
PNG
(US10266496, Example 25)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2oc(cc12)C(F)(F)F)C#N
Show InChI InChI=1S/C17H8F3NO4/c18-17(19,20)15-6-12-11(3-8(7-21)4-14(12)25-15)9-1-2-10(16(23)24)13(22)5-9/h1-6,22H,(H,23,24)
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n/an/a 68n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377697
PNG
(US10266496, Example 18)
Show SMILES Cc1cc2c(cc(cc2o1)C#N)-c1ccc(C(O)=O)c(O)c1
Show InChI InChI=1S/C17H11NO4/c1-9-4-14-13(5-10(8-18)6-16(14)22-9)11-2-3-12(17(20)21)15(19)7-11/h2-7,19H,1H3,(H,20,21)
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n/an/a 70n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377700
PNG
(US10266496, Example 27)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2oc(Cl)cc12)C#N
Show InChI InChI=1S/C16H8ClNO4/c17-15-6-12-11(3-8(7-18)4-14(12)22-15)9-1-2-10(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
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n/an/a 88.8n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377696
PNG
(US10266496, Example 17)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2ocnc12)C#N
Show InChI InChI=1S/C15H8N2O4/c16-6-8-3-11(14-13(4-8)21-7-17-14)9-1-2-10(15(19)20)12(18)5-9/h1-5,7,18H,(H,19,20)
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n/an/a 90.2n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377705
PNG
(US10266496, Example 33)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2sc(Cl)cc12)C#N
Show InChI InChI=1S/C16H8ClNO3S/c17-15-6-12-11(3-8(7-18)4-14(12)22-15)9-1-2-10(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
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n/an/a 91n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377693
PNG
(US10266496, Example 5)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cn2ccnc12)C#N
Show InChI InChI=1S/C15H9N3O3/c16-7-9-5-12(14-17-3-4-18(14)8-9)10-1-2-11(15(20)21)13(19)6-10/h1-6,8,19H,(H,20,21)
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n/an/a 94.8n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377691
PNG
(US10266496, Example 3)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2OCOc12)C#N
Show InChI InChI=1S/C15H9NO5/c16-6-8-3-11(14-13(4-8)20-7-21-14)9-1-2-10(15(18)19)12(17)5-9/h1-5,17H,7H2,(H,18,19)
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n/an/a 101n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377705
PNG
(US10266496, Example 33)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2sc(Cl)cc12)C#N
Show InChI InChI=1S/C16H8ClNO3S/c17-15-6-12-11(3-8(7-18)4-14(12)22-15)9-1-2-10(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
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n/an/a 102n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377689
PNG
(US10266496, Example 1)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2ccoc12)C#N
Show InChI InChI=1S/C16H9NO4/c17-8-9-5-11-3-4-21-15(11)13(6-9)10-1-2-12(16(19)20)14(18)7-10/h1-7,18H,(H,19,20)
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n/an/a 140n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377701
PNG
(US10266496, Example 28)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2oc(F)cc12)C#N
Show InChI InChI=1S/C16H8FNO4/c17-15-6-12-11(3-8(7-18)4-14(12)22-15)9-1-2-10(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
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n/an/a 146n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377699
PNG
(US10266496, Example 25)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2oc(cc12)C(F)(F)F)C#N
Show InChI InChI=1S/C17H8F3NO4/c18-17(19,20)15-6-12-11(3-8(7-21)4-14(12)25-15)9-1-2-10(16(23)24)13(22)5-9/h1-6,22H,(H,23,24)
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n/an/a 164n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377698
PNG
(US10266496, Example 21)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2occc12)C#N
Show InChI InChI=1S/C16H9NO4/c17-8-9-5-13(11-3-4-21-15(11)6-9)10-1-2-12(16(19)20)14(18)7-10/h1-7,18H,(H,19,20)
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n/an/a 172n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377703
PNG
(US10266496, Example 30)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2sc(F)cc12)C#N
Show InChI InChI=1S/C16H8FNO3S/c17-15-6-12-11(3-8(7-18)4-14(12)22-15)9-1-2-10(16(20)21)13(19)5-9/h1-6,19H,(H,20,21)
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n/an/a 179n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377693
PNG
(US10266496, Example 5)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cn2ccnc12)C#N
Show InChI InChI=1S/C15H9N3O3/c16-7-9-5-12(14-17-3-4-18(14)8-9)10-1-2-11(15(20)21)13(19)6-10/h1-6,8,19H,(H,20,21)
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n/an/a 179n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377694
PNG
(US10266496, Example 6)
Show SMILES Cn1c(cc2c(cc(cc12)C#N)-c1ccc(C(O)=O)c(O)c1)C(F)(F)F
Show InChI InChI=1S/C18H11F3N2O3/c1-23-14-5-9(8-22)4-12(13(14)7-16(23)18(19,20)21)10-2-3-11(17(25)26)15(24)6-10/h2-7,24H,1H3,(H,25,26)
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n/an/a 234n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377696
PNG
(US10266496, Example 17)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2ocnc12)C#N
Show InChI InChI=1S/C15H8N2O4/c16-6-8-3-11(14-13(4-8)21-7-17-14)9-1-2-10(15(19)20)12(18)5-9/h1-5,7,18H,(H,19,20)
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n/an/a 271n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377692
PNG
(US10266496, Example 4)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2CCOc12)C#N
Show InChI InChI=1S/C16H11NO4/c17-8-9-5-11-3-4-21-15(11)13(6-9)10-1-2-12(16(19)20)14(18)7-10/h1-2,5-7,18H,3-4H2,(H,19,20)
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n/an/a 499n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377574
PNG
(4-{[(1S)-1-(6-chloro-2-oxo- | US10266495, Compound...)
Show SMILES COc1cc(N[C@@H](C)c2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C19H16ClN3O2/c1-11(22-15-5-3-12(10-21)18(9-15)25-2)16-8-13-7-14(20)4-6-17(13)23-19(16)24/h3-9,11,22H,1-2H3,(H,23,24)/t11-/s2
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377638
PNG
(2-methoxy-4-{[(6-methyl-2-oxo-1,2-dihydroquinolin-...)
Show SMILES COc1cc(NCc2cc3cc(C)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C19H17N3O2/c1-12-3-6-17-14(7-12)8-15(19(23)22-17)11-21-16-5-4-13(10-20)18(9-16)24-2/h3-9,21H,11H2,1-2H3,(H,22,23)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377672
PNG
(4-[({6-chloro-2-oxo-7-[3-(piperidin-1-yl)propoxy]-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCCN4CCCCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C26H29ClN4O3/c1-33-24-14-21(7-6-18(24)16-28)29-17-20-12-19-13-22(27)25(15-23(19)30-26(20)32)34-11-5-10-31-8-3-2-4-9-31/h6-7,12-15,29H,2-5,8-11,17H2,1H3,(H,30,32)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377684
PNG
(4-{[(6-chloro-8- | US10266495, Compound I-96)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(O)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14ClN3O3/c1-25-16-7-14(3-2-10(16)8-20)21-9-12-4-11-5-13(19)6-15(23)17(11)22-18(12)24/h2-7,21,23H,9H2,1H3,(H,22,24)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377666
PNG
(4-[({6-chloro-7-[(1-methyl-1H-imidazol-2- | US1026...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4nccn4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C23H20ClN5O3/c1-29-6-5-26-22(29)13-32-21-10-19-15(8-18(21)24)7-16(23(30)28-19)12-27-17-4-3-14(11-25)20(9-17)31-2/h3-10,27H,12-13H2,1-2H3,(H,28,30)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377673
PNG
(4-[({6-chloro-2-oxo-7-[2-(pyrrolidin-1-yl)ethoxy]-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O3/c1-31-22-12-19(5-4-16(22)14-26)27-15-18-10-17-11-20(25)23(13-21(17)28-24(18)30)32-9-8-29-6-2-3-7-29/h4-5,10-13,27H,2-3,6-9,15H2,1H3,(H,28,30)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377596
PNG
(4-{[(6-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES Oc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C17H12ClN3O2/c18-13-2-4-15-11(6-13)5-12(17(23)21-15)9-20-14-3-1-10(8-19)16(22)7-14/h1-7,20,22H,9H2,(H,21,23)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377601
PNG
(4-{[(6-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES CCOc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C19H16ClN3O2/c1-2-25-18-9-16(5-3-12(18)10-21)22-11-14-7-13-8-15(20)4-6-17(13)23-19(14)24/h3-9,22H,2,11H2,1H3,(H,23,24)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377598
PNG
(4-{[(6-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES FC(F)(F)Oc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H11ClF3N3O2/c19-13-2-4-15-11(6-13)5-12(17(26)25-15)9-24-14-3-1-10(8-23)16(7-14)27-18(20,21)22/h1-7,24H,9H2,(H,25,26)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377599
PNG
(4-{[(6-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES OCCOc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C19H16ClN3O3/c20-15-2-4-17-13(8-15)7-14(19(25)23-17)11-22-16-3-1-12(10-21)18(9-16)26-6-5-24/h1-4,7-9,22,24H,5-6,11H2,(H,23,25)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377617
PNG
(4-{[(7-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES COc1cc(NCc2cc3ccc(Cl)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14ClN3O2/c1-24-17-8-15(5-3-12(17)9-20)21-10-13-6-11-2-4-14(19)7-16(11)22-18(13)23/h2-8,21H,10H2,1H3,(H,22,23)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377621
PNG
(6-chloro-3-({[3-methoxy-4-(1H-1,2,3,4-tetrazol-1- ...)
Show SMILES COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1-n1cnnn1
Show InChI InChI=1S/C18H15ClN6O2/c1-27-17-8-14(3-5-16(17)25-10-21-23-24-25)20-9-12-6-11-7-13(19)2-4-15(11)22-18(12)26/h2-8,10,20H,9H2,1H3,(H,22,26)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377622
PNG
(4-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US102...)
Show SMILES COc1cc(ccc1NCc1cc2cc(Cl)ccc2[nH]c1=O)C#N
Show InChI InChI=1S/C18H14ClN3O2/c1-24-17-6-11(9-20)2-4-16(17)21-10-13-7-12-8-14(19)3-5-15(12)22-18(13)23/h2-8,21H,10H2,1H3,(H,22,23)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377640
PNG
(2-methoxy-4-{[(6-methoxy-2-oxo-1,2-dihydroquinolin...)
Show SMILES COc1ccc2[nH]c(=O)c(CNc3ccc(C#N)c(OC)c3)cc2c1
Show InChI InChI=1S/C19H17N3O3/c1-24-16-5-6-17-13(8-16)7-14(19(23)22-17)11-21-15-4-3-12(10-20)18(9-15)25-2/h3-9,21H,11H2,1-2H3,(H,22,23)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377665
PNG
(4-[({6-chloro-7-[(1-methyl-1H-imidazol-5- | US1026...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4cncn4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C23H20ClN5O3/c1-29-13-26-11-18(29)12-32-22-8-20-15(6-19(22)24)5-16(23(30)28-20)10-27-17-4-3-14(9-25)21(7-17)31-2/h3-8,11,13,27H,10,12H2,1-2H3,(H,28,30)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377609
PNG
(4-{[(6-chloro-7-methoxy-2-oxo- | US10266495, Compo...)
Show SMILES COc1cc2[nH]c(=O)c(CNc3ccc(C#N)c(OC)c3)cc2cc1Cl
Show InChI InChI=1S/C19H16ClN3O3/c1-25-17-7-14(4-3-11(17)9-21)22-10-13-5-12-6-15(20)18(26-2)8-16(12)23-19(13)24/h3-8,22H,10H2,1-2H3,(H,23,24)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377618
PNG
(4-{[(7-hydroxy-2-oxo-1,2- | US10266495, Compound I...)
Show SMILES COc1cc(NCc2cc3ccc(O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H15N3O3/c1-24-17-7-14(4-2-12(17)9-19)20-10-13-6-11-3-5-15(22)8-16(11)21-18(13)23/h2-8,20,22H,10H2,1H3,(H,21,23)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377620
PNG
(4-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US102...)
Show SMILES Clc1ccc2cc(CNc3ccc(cc3)C#N)c(=O)[nH]c2c1
Show InChI InChI=1S/C17H12ClN3O/c18-14-4-3-12-7-13(17(22)21-16(12)8-14)10-20-15-5-1-11(9-19)2-6-15/h1-8,20H,10H2,(H,21,22)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377624
PNG
(4-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US102...)
Show SMILES Cc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14ClN3O/c1-11-6-16(4-2-12(11)9-20)21-10-14-7-13-8-15(19)3-5-17(13)22-18(14)23/h2-8,21H,10H2,1H3,(H,22,23)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377646
PNG
(4-({[6-chloro-2-oxo-7-(pyridin-2-ylmethoxy)-1,2- |...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4ccccn4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H19ClN4O3/c1-31-22-10-18(6-5-15(22)12-26)28-13-17-8-16-9-20(25)23(11-21(16)29-24(17)30)32-14-19-4-2-3-7-27-19/h2-11,28H,13-14H2,1H3,(H,29,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377647
PNG
(4-[({6-chloro-7-[2-hydroxy-3-(morpholin-4- | US102...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC(O)CN4CCOCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C25H27ClN4O5/c1-33-23-10-19(3-2-16(23)12-27)28-13-18-8-17-9-21(26)24(11-22(17)29-25(18)32)35-15-20(31)14-30-4-6-34-7-5-30/h2-3,8-11,20,28,31H,4-7,13-15H2,1H3,(H,29,32)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377648
PNG
(4-[({6-chloro-7-[2-(morpholin-4-yl)ethoxy]-2-oxo-1...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCOCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O4/c1-31-22-12-19(3-2-16(22)14-26)27-15-18-10-17-11-20(25)23(13-21(17)28-24(18)30)33-9-6-29-4-7-32-8-5-29/h2-3,10-13,27H,4-9,15H2,1H3,(H,28,30)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377652
PNG
(4-[({6-chloro-7-[2-(4-methanesulfonylpiperazin-1- ...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCN(CC4)S(C)(=O)=O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H28ClN5O5S/c1-35-23-13-20(4-3-17(23)15-27)28-16-19-11-18-12-21(26)24(14-22(18)29-25(19)32)36-10-9-30-5-7-31(8-6-30)37(2,33)34/h3-4,11-14,28H,5-10,16H2,1-2H3,(H,29,32)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377658
PNG
(4-[({6-chloro-7-[(1,5-dimethyl-1H-pyrazol-3- | US1...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4cc(C)n(C)n4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H22ClN5O3/c1-14-6-19(29-30(14)2)13-33-23-10-21-16(8-20(23)25)7-17(24(31)28-21)12-27-18-5-4-15(11-26)22(9-18)32-3/h4-10,27H,12-13H2,1-3H3,(H,28,31)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377667
PNG
(5-{[(6-chloro-3-{[(4-cyano-3- | US10266495, Compou...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4nc(no4)C(N)=O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C22H17ClN6O5/c1-32-17-6-14(3-2-11(17)8-24)26-9-13-4-12-5-15(23)18(7-16(12)27-22(13)31)33-10-19-28-21(20(25)30)29-34-19/h2-7,26H,9-10H2,1H3,(H2,25,30)(H,27,31)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377679
PNG
(4-[({6-chloro-7-[2-(1,1-dioxo-1lambda6,4-thiomorph...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCS(=O)(=O)CC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O5S/c1-33-22-12-19(3-2-16(22)14-26)27-15-18-10-17-11-20(25)23(13-21(17)28-24(18)30)34-7-4-29-5-8-35(31,32)9-6-29/h2-3,10-13,27H,4-9,15H2,1H3,(H,28,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377683
PNG
(4-{[(6-chloro-8-methyl- | US10266495, Compound I-9...)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(C)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C19H16ClN3O2/c1-11-5-15(20)7-13-6-14(19(24)23-18(11)13)10-22-16-4-3-12(9-21)17(8-16)25-2/h3-8,22H,10H2,1-2H3,(H,23,24)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377593
PNG
(4-({1-[6-chloro-2-oxo-7- | US10266495, Compound I-...)
Show SMILES COc1cc(NC(C)c2cc3cc(Cl)c(OCc4ccccn4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C25H21ClN4O3/c1-15(29-18-7-6-16(13-27)23(11-18)32-2)20-9-17-10-21(26)24(12-22(17)30-25(20)31)33-14-19-5-3-4-8-28-19/h3-12,15,29H,14H2,1-2H3,(H,30,31)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377623
PNG
(4-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US102...)
Show SMILES FC(F)(F)c1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H11ClF3N3O/c19-13-2-4-16-11(6-13)5-12(17(26)25-16)9-24-14-3-1-10(8-23)15(7-14)18(20,21)22/h1-7,24H,9H2,(H,25,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377625
PNG
(4-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US102...)
Show SMILES Fc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C17H11ClFN3O/c18-13-2-4-16-11(6-13)5-12(17(23)22-16)9-21-14-3-1-10(8-20)15(19)7-14/h1-7,21H,9H2,(H,22,23)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377626
PNG
(6-chloro-3-({[4-(5-methyl-1H-1,2,3,4-tetrazol-1- |...)
Show SMILES Cc1nnnn1-c1ccc(NCc2cc3cc(Cl)ccc3[nH]c2=O)cc1
Show InChI InChI=1S/C18H15ClN6O/c1-11-22-23-24-25(11)16-5-3-15(4-6-16)20-10-13-8-12-9-14(19)2-7-17(12)21-18(13)26/h2-9,20H,10H2,1H3,(H,21,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377656
PNG
(2-[(6-chloro-3-{[(4-cyano-3- | US10266495, Compoun...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC(N)=O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C20H17ClN4O4/c1-28-17-6-14(3-2-11(17)8-22)24-9-13-4-12-5-15(21)18(29-10-19(23)26)7-16(12)25-20(13)27/h2-7,24H,9-10H2,1H3,(H2,23,26)(H,25,27)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377663
PNG
(4-[({6-chloro-7-[(1,1-dioxo-1lambda6-thian-4-yl)me...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC4CCS(=O)(=O)CC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H24ClN3O5S/c1-32-22-10-19(3-2-16(22)12-26)27-13-18-8-17-9-20(25)23(11-21(17)28-24(18)29)33-14-15-4-6-34(30,31)7-5-15/h2-3,8-11,15,27H,4-7,13-14H2,1H3,(H,28,29)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377670
PNG
(4-[({6-chloro-7-[3-(dimethylamino)propoxy]-2-oxo- ...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCCN(C)C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C23H25ClN4O3/c1-28(2)7-4-8-31-22-12-20-16(10-19(22)24)9-17(23(29)27-20)14-26-18-6-5-15(13-25)21(11-18)30-3/h5-6,9-12,26H,4,7-8,14H2,1-3H3,(H,27,29)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377687
PNG
(4-[({6-chloro-8-[2- | US10266495, Compound I-99)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(OCCN4CCOCC4)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O4/c1-31-21-13-20(3-2-16(21)14-26)27-15-18-10-17-11-19(25)12-22(23(17)28-24(18)30)33-9-6-29-4-7-32-8-5-29/h2-3,10-13,27H,4-9,15H2,1H3,(H,28,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377595
PNG
(4-{[(6-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14ClN3O2/c1-24-17-8-15(4-2-11(17)9-20)21-10-13-6-12-7-14(19)3-5-16(12)22-18(13)23/h2-8,21H,10H2,1H3,(H,22,23)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
IDH1 R132H


(Homo sapiens (Human))
BDBM377597
PNG
(4-{[(6-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)cc(OC)c1C#N
Show InChI InChI=1S/C19H16ClN3O3/c1-25-17-7-14(8-18(26-2)15(17)9-21)22-10-12-5-11-6-13(20)3-4-16(11)23-19(12)24/h3-8,22H,10H2,1-2H3,(H,23,24)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377604
PNG
(3-({[3-methoxy-4-(1H-1,2,3,4- | US10266495, Compou...)
Show SMILES COc1cc(NCc2cc3cc(C)ccc3[nH]c2=O)ccc1-n1cnnn1
Show InChI InChI=1S/C19H18N6O2/c1-12-3-5-16-13(7-12)8-14(19(26)22-16)10-20-15-4-6-17(18(9-15)27-2)25-11-21-23-24-25/h3-9,11,20H,10H2,1-2H3,(H,22,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377608
PNG
(3-({[3-methoxy-4-(1H-1,2,3,4- | US10266495, Compou...)
Show SMILES COc1cc(NCc2cc3cc(C)c(C)cc3[nH]c2=O)ccc1-n1cnnn1
Show InChI InChI=1S/C20H20N6O2/c1-12-6-14-8-15(20(27)23-17(14)7-13(12)2)10-21-16-4-5-18(19(9-16)28-3)26-11-22-24-25-26/h4-9,11,21H,10H2,1-3H3,(H,23,27)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377609
PNG
(4-{[(6-chloro-7-methoxy-2-oxo- | US10266495, Compo...)
Show SMILES COc1cc2[nH]c(=O)c(CNc3ccc(C#N)c(OC)c3)cc2cc1Cl
Show InChI InChI=1S/C19H16ClN3O3/c1-25-17-7-14(4-3-11(17)9-21)22-10-13-5-12-6-15(20)18(26-2)8-16(12)23-19(13)24/h3-8,22H,10H2,1-2H3,(H,23,24)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377610
PNG
(3-({[3-methoxy-4-(1H-1,2,3,4- | US10266495, Compou...)
Show SMILES COc1cc(NCc2cc3ccc(C)cc3[nH]c2=O)ccc1-n1cnnn1
Show InChI InChI=1S/C19H18N6O2/c1-12-3-4-13-8-14(19(26)22-16(13)7-12)10-20-15-5-6-17(18(9-15)27-2)25-11-21-23-24-25/h3-9,11,20H,10H2,1-2H3,(H,22,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377642
PNG
(2-methoxy-4-{[(7-methyl-2-oxo-1,2-dihydroquinolin-...)
Show SMILES COc1cc(NCc2cc3ccc(C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C19H17N3O2/c1-12-3-4-13-8-15(19(23)22-17(13)7-12)11-21-16-6-5-14(10-20)18(9-16)24-2/h3-9,21H,11H2,1-2H3,(H,22,23)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377643
PNG
(4-{[(6-ethoxy-2-oxo-1,2-dihydroquinolin-3- | US102...)
Show SMILES CCOc1ccc2[nH]c(=O)c(CNc3ccc(C#N)c(OC)c3)cc2c1
Show InChI InChI=1S/C20H19N3O3/c1-3-26-17-6-7-18-14(9-17)8-15(20(24)23-18)12-22-16-5-4-13(11-21)19(10-16)25-2/h4-10,22H,3,12H2,1-2H3,(H,23,24)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377662
PNG
(4-({[6-chloro-2-oxo-7-(pyridin-4-ylmethoxy)-1,2- |...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4ccncc4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H19ClN4O3/c1-31-22-10-19(3-2-16(22)12-26)28-13-18-8-17-9-20(25)23(11-21(17)29-24(18)30)32-14-15-4-6-27-7-5-15/h2-11,28H,13-14H2,1H3,(H,29,30)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377678
PNG
(4-[({6-chloro-7-[2-(2-methyl-1H-imidazol-1- | US10...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCn4ccnc4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H22ClN5O3/c1-15-27-5-6-30(15)7-8-33-23-12-21-17(10-20(23)25)9-18(24(31)29-21)14-28-19-4-3-16(13-26)22(11-19)32-2/h3-6,9-12,28H,7-8,14H2,1-2H3,(H,29,31)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377681
PNG
(4-({[6-chloro-7-(2-ethoxyethoxy)-2-oxo-1,2- | US10...)
Show SMILES CCOCCOc1cc2[nH]c(=O)c(CNc3ccc(cc3)C#N)cc2cc1Cl
Show InChI InChI=1S/C21H20ClN3O3/c1-2-27-7-8-28-20-11-19-15(10-18(20)22)9-16(21(26)25-19)13-24-17-5-3-14(12-23)4-6-17/h3-6,9-11,24H,2,7-8,13H2,1H3,(H,25,26)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377688
PNG
(4-[({6-chloro-2-oxo-8- | US10266495, Compound I-10...)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(OCCN4CCCC4)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O3/c1-31-21-13-20(5-4-16(21)14-26)27-15-18-10-17-11-19(25)12-22(23(17)28-24(18)30)32-9-8-29-6-2-3-7-29/h4-5,10-13,27H,2-3,6-9,15H2,1H3,(H,28,30)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377616
PNG
(4-{[(6-iodo-2-oxo-1,2- | US10266495, Compound I-28)
Show SMILES COc1cc(NCc2cc3cc(I)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14IN3O2/c1-24-17-8-15(4-2-11(17)9-20)21-10-13-6-12-7-14(19)3-5-16(12)22-18(13)23/h2-8,21H,10H2,1H3,(H,22,23)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377635
PNG
(2-methoxy-4-{[(2-oxo-1,2-dihydroquinolin-3- | US10...)
Show SMILES COc1cc(NCc2cc3ccccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H15N3O2/c1-23-17-9-15(7-6-13(17)10-19)20-11-14-8-12-4-2-3-5-16(12)21-18(14)22/h2-9,20H,11H2,1H3,(H,21,22)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377644
PNG
(2-methoxy-4-{[(7-methoxy-2-oxo-1,2-dihydroquinolin...)
Show SMILES COc1ccc2cc(CNc3ccc(C#N)c(OC)c3)c(=O)[nH]c2c1
Show InChI InChI=1S/C19H17N3O3/c1-24-16-6-4-12-7-14(19(23)22-17(12)9-16)11-21-15-5-3-13(10-20)18(8-15)25-2/h3-9,21H,11H2,1-2H3,(H,22,23)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377680
PNG
(4-[({6-chloro-7-[2-(3,5-dimethyl-1H-pyrazol-1- | U...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCn4nc(C)cc4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H24ClN5O3/c1-15-8-16(2)31(30-15)6-7-34-24-12-22-18(10-21(24)26)9-19(25(32)29-22)14-28-20-5-4-17(13-27)23(11-20)33-3/h4-5,8-12,28H,6-7,14H2,1-3H3,(H,29,32)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377685
PNG
(4-{[(6-chloro-8- | US10266495, Compound I-97)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(OC)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C19H16ClN3O3/c1-25-16-8-15(4-3-11(16)9-21)22-10-13-5-12-6-14(20)7-17(26-2)18(12)23-19(13)24/h3-8,22H,10H2,1-2H3,(H,23,24)
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n/an/a 550n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM377690
PNG
(US10266496, Example 2)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2ccccc12)C#N
Show InChI InChI=1S/C18H11NO3/c19-10-11-7-12-3-1-2-4-14(12)16(8-11)13-5-6-15(18(21)22)17(20)9-13/h1-9,20H,(H,21,22)
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n/an/a 667n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
The compound was diluted 2.5 fold with a buffer of 50 mM KH2PO4 to give a series of concentrations from 2000 nM to 0.524 nM. Then the diluted solutio...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377691
PNG
(US10266496, Example 3)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2OCOc12)C#N
Show InChI InChI=1S/C15H9NO5/c16-6-8-3-11(14-13(4-8)20-7-21-14)9-1-2-10(15(18)19)12(17)5-9/h1-5,17H,7H2,(H,18,19)
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n/an/a 804n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377627
PNG
(6-chloro-3-({[4-(1H-imidazol-1- | US10266495, Comp...)
Show SMILES Clc1ccc2[nH]c(=O)c(CNc3ccc(cc3)-n3ccnc3)cc2c1
Show InChI InChI=1S/C19H15ClN4O/c20-15-1-6-18-13(10-15)9-14(19(25)23-18)11-22-16-2-4-17(5-3-16)24-8-7-21-12-24/h1-10,12,22H,11H2,(H,23,25)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377630
PNG
(4-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US102...)
Show SMILES CNC(=O)c1ccc(NCc2cc3cc(Cl)ccc3[nH]c2=O)cc1
Show InChI InChI=1S/C18H16ClN3O2/c1-20-17(23)11-2-5-15(6-3-11)21-10-13-8-12-9-14(19)4-7-16(12)22-18(13)24/h2-9,21H,10H2,1H3,(H,20,23)(H,22,24)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377641
PNG
(3-({[4-(1H-imidazol-1-yl)phenyl]amino}methyl)-6- |...)
Show SMILES COc1ccc2[nH]c(=O)c(CNc3ccc(cc3)-n3ccnc3)cc2c1
Show InChI InChI=1S/C20H18N4O2/c1-26-18-6-7-19-14(11-18)10-15(20(25)23-19)12-22-16-2-4-17(5-3-16)24-9-8-21-13-24/h2-11,13,22H,12H2,1H3,(H,23,25)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377660
PNG
(4-[({6-chloro-7-[(1-methylpiperidin-2-yl)methoxy]-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC4CCCCN4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C25H27ClN4O3/c1-30-8-4-3-5-20(30)15-33-24-12-22-17(10-21(24)26)9-18(25(31)29-22)14-28-19-7-6-16(13-27)23(11-19)32-2/h6-7,9-12,20,28H,3-5,8,14-15H2,1-2H3,(H,29,31)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377664
PNG
(4-({[6-chloro-2-oxo-7-(pyrazin-2-ylmethoxy)-1,2- |...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4cnccn4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C23H18ClN5O3/c1-31-21-8-17(3-2-14(21)10-25)28-11-16-6-15-7-19(24)22(9-20(15)29-23(16)30)32-13-18-12-26-4-5-27-18/h2-9,12,28H,11,13H2,1H3,(H,29,30)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377674
PNG
(4-[({6-chloro-2-oxo-7-[2-(2-oxopyrrolidin-1- | US1...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCCC4=O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H23ClN4O4/c1-32-21-11-18(5-4-15(21)13-26)27-14-17-9-16-10-19(25)22(12-20(16)28-24(17)31)33-8-7-29-6-2-3-23(29)30/h4-5,9-12,27H,2-3,6-8,14H2,1H3,(H,28,31)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377597
PNG
(4-{[(6-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)cc(OC)c1C#N
Show InChI InChI=1S/C19H16ClN3O3/c1-25-17-7-14(8-18(26-2)15(17)9-21)22-10-12-5-11-6-13(20)3-4-16(11)23-19(12)24/h3-8,22H,10H2,1-2H3,(H,23,24)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377607
PNG
(N-(3,4-dihydro-2H-pyrrol-5-yl)- | US10266495, Comp...)
Show SMILES Cc1cc2cc(CNc3cccc(c3)S(=O)(=O)NC3=NCCC3)c(=O)[nH]c2cc1C
Show InChI InChI=1S/C22H24N4O3S/c1-14-9-16-11-17(22(27)25-20(16)10-15(14)2)13-24-18-5-3-6-19(12-18)30(28,29)26-21-7-4-8-23-21/h3,5-6,9-12,24H,4,7-8,13H2,1-2H3,(H,23,26)(H,25,27)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377612
PNG
(4-{[(6-tert-butyl-2-oxo-1,2- | US10266495, Compoun...)
Show SMILES COc1cc(NCc2cc3cc(ccc3[nH]c2=O)C(C)(C)C)ccc1C#N
Show InChI InChI=1S/C22H23N3O2/c1-22(2,3)17-6-8-19-15(10-17)9-16(21(26)25-19)13-24-18-7-5-14(12-23)20(11-18)27-4/h5-11,24H,13H2,1-4H3,(H,25,26)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377619
PNG
(2-methoxy-4-{[(2-oxo-1,2- | US10266495, Compound I...)
Show SMILES COc1cc(NCc2cc3cccnc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C17H14N4O2/c1-23-15-8-14(5-4-12(15)9-18)20-10-13-7-11-3-2-6-19-16(11)21-17(13)22/h2-8,20H,10H2,1H3,(H,19,21,22)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377629
PNG
(6-chloro-3-{[(4-fluoro-3-methoxyphenyl)amino]methy...)
Show SMILES COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1F
Show InChI InChI=1S/C17H14ClFN2O2/c1-23-16-8-13(3-4-14(16)19)20-9-11-6-10-7-12(18)2-5-15(10)21-17(11)22/h2-8,20H,9H2,1H3,(H,21,22)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377631
PNG
(2-(4-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US...)
Show SMILES NC(=O)COc1ccc(NCc2cc3cc(Cl)ccc3[nH]c2=O)cc1
Show InChI InChI=1S/C18H16ClN3O3/c19-13-1-6-16-11(8-13)7-12(18(24)22-16)9-21-14-2-4-15(5-3-14)25-10-17(20)23/h1-8,21H,9-10H2,(H2,20,23)(H,22,24)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377647
PNG
(4-[({6-chloro-7-[2-hydroxy-3-(morpholin-4- | US102...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC(O)CN4CCOCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C25H27ClN4O5/c1-33-23-10-19(3-2-16(23)12-27)28-13-18-8-17-9-21(26)24(11-22(17)29-25(18)32)35-15-20(31)14-30-4-6-34-7-5-30/h2-3,8-11,20,28,31H,4-7,13-15H2,1H3,(H,29,32)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377670
PNG
(4-[({6-chloro-7-[3-(dimethylamino)propoxy]-2-oxo- ...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCCN(C)C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C23H25ClN4O3/c1-28(2)7-4-8-31-22-12-20-16(10-19(22)24)9-17(23(29)27-20)14-26-18-6-5-15(13-25)21(11-18)30-3/h5-6,9-12,26H,4,7-8,14H2,1-3H3,(H,27,29)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377671
PNG
(4-[({6-chloro-2-oxo-7-[3-(pyrrolidin-1-yl)propoxy]...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCCN4CCCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H27ClN4O3/c1-32-23-13-20(6-5-17(23)15-27)28-16-19-11-18-12-21(26)24(14-22(18)29-25(19)31)33-10-4-9-30-7-2-3-8-30/h5-6,11-14,28H,2-4,7-10,16H2,1H3,(H,29,31)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377672
PNG
(4-[({6-chloro-2-oxo-7-[3-(piperidin-1-yl)propoxy]-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCCN4CCCCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C26H29ClN4O3/c1-33-24-14-21(7-6-18(24)16-28)29-17-20-12-19-13-22(27)25(15-23(19)30-26(20)32)34-11-5-10-31-8-3-2-4-9-31/h6-7,12-15,29H,2-5,8-11,17H2,1H3,(H,30,32)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377680
PNG
(4-[({6-chloro-7-[2-(3,5-dimethyl-1H-pyrazol-1- | U...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCn4nc(C)cc4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H24ClN5O3/c1-15-8-16(2)31(30-15)6-7-34-24-12-22-18(10-21(24)26)9-19(25(32)29-22)14-28-20-5-4-17(13-27)23(11-20)33-3/h4-5,8-12,28H,6-7,14H2,1-3H3,(H,29,32)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377602
PNG
(2-(5-{[(6-chloro-2-oxo-1,2- | US10266495, Compound...)
Show SMILES NC(=O)COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C19H15ClN4O3/c20-14-2-4-16-12(6-14)5-13(19(26)24-16)9-23-15-3-1-11(8-21)17(7-15)27-10-18(22)25/h1-7,23H,9-10H2,(H2,22,25)(H,24,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377605
PNG
(4-{[(6,7-dimethyl-2-oxo-1,2- | US10266495, Compoun...)
Show SMILES COc1cc(NCc2cc3cc(C)c(C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C20H19N3O2/c1-12-6-15-8-16(20(24)23-18(15)7-13(12)2)11-22-17-5-4-14(10-21)19(9-17)25-3/h4-9,22H,11H2,1-3H3,(H,23,24)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377615
PNG
(4-{[(6-fluoro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES COc1cc(NCc2cc3cc(F)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14FN3O2/c1-24-17-8-15(4-2-11(17)9-20)21-10-13-6-12-7-14(19)3-5-16(12)22-18(13)23/h2-8,21H,10H2,1H3,(H,22,23)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377633
PNG
(2-(3-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US...)
Show SMILES Clc1ccc2[nH]c(=O)c(CNc3cccc(CC#N)c3)cc2c1
Show InChI InChI=1S/C18H14ClN3O/c19-15-4-5-17-13(10-15)9-14(18(23)22-17)11-21-16-3-1-2-12(8-16)6-7-20/h1-5,8-10,21H,6,11H2,(H,22,23)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377634
PNG
(6-chloro-3-{[(2-fluorophenyl)amino]methyl}-1,2- | ...)
Show SMILES Fc1ccccc1NCc1cc2cc(Cl)ccc2[nH]c1=O
Show InChI InChI=1S/C16H12ClFN2O/c17-12-5-6-14-10(8-12)7-11(16(21)20-14)9-19-15-4-2-1-3-13(15)18/h1-8,19H,9H2,(H,20,21)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377635
PNG
(2-methoxy-4-{[(2-oxo-1,2-dihydroquinolin-3- | US10...)
Show SMILES COc1cc(NCc2cc3ccccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H15N3O2/c1-23-17-9-15(7-6-13(17)10-19)20-11-14-8-12-4-2-3-5-16(12)21-18(14)22/h2-9,20H,11H2,1H3,(H,21,22)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377659
PNG
(4-({[7-(benzyloxy)-6-chloro-2-oxo-1,2- | US1026649...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4ccccc4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H20ClN3O3/c1-31-23-11-20(8-7-17(23)13-27)28-14-19-9-18-10-21(26)24(12-22(18)29-25(19)30)32-15-16-5-3-2-4-6-16/h2-12,28H,14-15H2,1H3,(H,29,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377685
PNG
(4-{[(6-chloro-8- | US10266495, Compound I-97)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(OC)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C19H16ClN3O3/c1-25-16-8-15(4-3-11(16)9-21)22-10-13-5-12-6-14(20)7-17(26-2)18(12)23-19(13)24/h3-8,22H,10H2,1-2H3,(H,23,24)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377687
PNG
(4-[({6-chloro-8-[2- | US10266495, Compound I-99)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(OCCN4CCOCC4)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O4/c1-31-21-13-20(3-2-16(21)14-26)27-15-18-10-17-11-19(25)12-22(23(17)28-24(18)30)33-9-6-29-4-7-32-8-5-29/h2-3,10-13,27H,4-9,15H2,1H3,(H,28,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377591
PNG
(4-{[(1R)-1-(6-chloro-2-oxo- | US10266495, Compound...)
Show SMILES COc1cc(N[C@H](C)c2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C19H16ClN3O2/c1-11(22-15-5-3-12(10-21)18(9-15)25-2)16-8-13-7-14(20)4-6-17(13)23-19(16)24/h3-9,11,22H,1-2H3,(H,23,24)/t11-/s2
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377610
PNG
(3-({[3-methoxy-4-(1H-1,2,3,4- | US10266495, Compou...)
Show SMILES COc1cc(NCc2cc3ccc(C)cc3[nH]c2=O)ccc1-n1cnnn1
Show InChI InChI=1S/C19H18N6O2/c1-12-3-4-13-8-14(19(26)22-16(13)7-12)10-20-15-5-6-17(18(9-15)27-2)25-11-21-23-24-25/h3-9,11,20H,10H2,1-2H3,(H,22,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377632
PNG
(6-chloro-3-{[(4-chloro-3-methoxyphenyl)amino]methy...)
Show SMILES COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1Cl
Show InChI InChI=1S/C17H14Cl2N2O2/c1-23-16-8-13(3-4-14(16)19)20-9-11-6-10-7-12(18)2-5-15(10)21-17(11)22/h2-8,20H,9H2,1H3,(H,21,22)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377636
PNG
(3-({[3-methoxy-4-(1H-1,2,3,4-tetrazol-1- | US10266...)
Show SMILES COc1cc(NCc2cc3ccccc3[nH]c2=O)ccc1-n1cnnn1
Show InChI InChI=1S/C18H16N6O2/c1-26-17-9-14(6-7-16(17)24-11-20-22-23-24)19-10-13-8-12-4-2-3-5-15(12)21-18(13)25/h2-9,11,19H,10H2,1H3,(H,21,25)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377639
PNG
(6,7-dimethyl-3-({[4-(1H-1,2,3,4-tetrazol-1- | US10...)
Show SMILES Cc1cc2cc(CNc3ccc(cc3)-n3cnnn3)c(=O)[nH]c2cc1C
Show InChI InChI=1S/C19H18N6O/c1-12-7-14-9-15(19(26)22-18(14)8-13(12)2)10-20-16-3-5-17(6-4-16)25-11-21-23-24-25/h3-9,11,20H,10H2,1-2H3,(H,22,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377673
PNG
(4-[({6-chloro-2-oxo-7-[2-(pyrrolidin-1-yl)ethoxy]-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O3/c1-31-22-12-19(5-4-16(22)14-26)27-15-18-10-17-11-20(25)23(13-21(17)28-24(18)30)32-9-8-29-6-2-3-7-29/h4-5,10-13,27H,2-3,6-9,15H2,1H3,(H,28,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377679
PNG
(4-[({6-chloro-7-[2-(1,1-dioxo-1lambda6,4-thiomorph...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCS(=O)(=O)CC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O5S/c1-33-22-12-19(3-2-16(22)14-26)27-15-18-10-17-11-20(25)23(13-21(17)28-24(18)30)34-7-4-29-5-8-35(31,32)9-6-29/h2-3,10-13,27H,4-9,15H2,1H3,(H,28,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377688
PNG
(4-[({6-chloro-2-oxo-8- | US10266495, Compound I-10...)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(OCCN4CCCC4)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O3/c1-31-21-13-20(5-4-16(21)14-26)27-15-18-10-17-11-19(25)12-22(23(17)28-24(18)30)32-9-8-29-6-2-3-7-29/h4-5,10-13,27H,2-3,6-9,15H2,1H3,(H,28,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377595
PNG
(4-{[(6-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14ClN3O2/c1-24-17-8-15(4-2-11(17)9-20)21-10-13-6-12-7-14(19)3-5-16(12)22-18(13)23/h2-8,21H,10H2,1H3,(H,22,23)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
IDH1 R132C


(Homo sapiens (Human))
BDBM377615
PNG
(4-{[(6-fluoro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES COc1cc(NCc2cc3cc(F)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14FN3O2/c1-24-17-8-15(4-2-11(17)9-20)21-10-13-6-12-7-14(19)3-5-16(12)22-18(13)23/h2-8,21H,10H2,1H3,(H,22,23)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377626
PNG
(6-chloro-3-({[4-(5-methyl-1H-1,2,3,4-tetrazol-1- |...)
Show SMILES Cc1nnnn1-c1ccc(NCc2cc3cc(Cl)ccc3[nH]c2=O)cc1
Show InChI InChI=1S/C18H15ClN6O/c1-11-22-23-24-25(11)16-5-3-15(4-6-16)20-10-13-8-12-9-14(19)2-7-17(12)21-18(13)26/h2-9,20H,10H2,1H3,(H,21,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377628
PNG
(2-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US102...)
Show SMILES NC(=O)c1ccccc1NCc1cc2cc(Cl)ccc2[nH]c1=O
Show InChI InChI=1S/C17H14ClN3O2/c18-12-5-6-14-10(8-12)7-11(17(23)21-14)9-20-15-4-2-1-3-13(15)16(19)22/h1-8,20H,9H2,(H2,19,22)(H,21,23)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377650
PNG
(4-({[6-chloro-2-oxo-7-(pyridin-3-ylmethoxy)-1,2- |...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4cccnc4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H19ClN4O3/c1-31-22-9-19(5-4-16(22)11-26)28-13-18-7-17-8-20(25)23(10-21(17)29-24(18)30)32-14-15-3-2-6-27-12-15/h2-10,12,28H,13-14H2,1H3,(H,29,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377663
PNG
(4-[({6-chloro-7-[(1,1-dioxo-1lambda6-thian-4-yl)me...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC4CCS(=O)(=O)CC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H24ClN3O5S/c1-32-22-10-19(3-2-16(22)12-26)27-13-18-8-17-9-20(25)23(11-21(17)28-24(18)29)33-14-15-4-6-34(30,31)7-5-15/h2-3,8-11,15,27H,4-7,13-14H2,1H3,(H,28,29)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377668
PNG
(4-[({6-chloro-2-oxo-7-[2-(pyridin-2-yl)ethoxy]-1,2...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCc4ccccn4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H21ClN4O3/c1-32-23-12-20(6-5-16(23)14-27)29-15-18-10-17-11-21(26)24(13-22(17)30-25(18)31)33-9-7-19-4-2-3-8-28-19/h2-6,8,10-13,29H,7,9,15H2,1H3,(H,30,31)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377669
PNG
(4-[({6-chloro-2-oxo-7-[2-(pyridin-4-yl)ethoxy]-1,2...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCc4ccncc4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H21ClN4O3/c1-32-23-12-20(3-2-17(23)14-27)29-15-19-10-18-11-21(26)24(13-22(18)30-25(19)31)33-9-6-16-4-7-28-8-5-16/h2-5,7-8,10-13,29H,6,9,15H2,1H3,(H,30,31)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377598
PNG
(4-{[(6-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES FC(F)(F)Oc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H11ClF3N3O2/c19-13-2-4-15-11(6-13)5-12(17(26)25-15)9-24-14-3-1-10(8-23)16(7-14)27-18(20,21)22/h1-7,24H,9H2,(H,25,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377624
PNG
(4-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US102...)
Show SMILES Cc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H14ClN3O/c1-11-6-16(4-2-12(11)9-20)21-10-14-7-13-8-15(19)3-5-17(13)22-18(14)23/h2-8,21H,10H2,1H3,(H,22,23)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377649
PNG
(4-[({6-chloro-7-[2-(dimethylamino)ethoxy]-2-oxo-1,...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN(C)C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C22H23ClN4O3/c1-27(2)6-7-30-21-11-19-15(9-18(21)23)8-16(22(28)26-19)13-25-17-5-4-14(12-24)20(10-17)29-3/h4-5,8-11,25H,6-7,13H2,1-3H3,(H,26,28)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377675
PNG
(4-[({6-chloro-2-oxo-7-[2-(piperidin-1-yl)ethoxy]-1...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCCCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H27ClN4O3/c1-32-23-13-20(6-5-17(23)15-27)28-16-19-11-18-12-21(26)24(14-22(18)29-25(19)31)33-10-9-30-7-3-2-4-8-30/h5-6,11-14,28H,2-4,7-10,16H2,1H3,(H,29,31)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377682
PNG
(4-{[(6-chloro-7-{[(2S)-1-methylpyrrolidin-2- | US1...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OC[C@@H]4CCCN4C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C24H25ClN4O3/c1-29-7-3-4-19(29)14-32-23-11-21-16(9-20(23)25)8-17(24(30)28-21)13-27-18-6-5-15(12-26)22(10-18)31-2/h5-6,8-11,19,27H,3-4,7,13-14H2,1-2H3,(H,28,30)/t19-/s2
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377683
PNG
(4-{[(6-chloro-8-methyl- | US10266495, Compound I-9...)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(C)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C19H16ClN3O2/c1-11-5-15(20)7-13-6-14(19(24)23-18(11)13)10-22-16-4-3-12(9-21)17(8-16)25-2/h3-8,22H,10H2,1-2H3,(H,23,24)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377592
PNG
(4-{[(1S)-1-(6-chloro-2-oxo- | US10266495, Compound...)
Show SMILES CS(=O)(=O)c1cc(ccc1NCc1cc2cc(Cl)ccc2[nH]c1=O)C#N
Show InChI InChI=1S/C18H14ClN3O3S/c1-26(24,25)17-6-11(9-20)2-4-16(17)21-10-13-7-12-8-14(19)3-5-15(12)22-18(13)23/h2-8,21H,10H2,1H3,(H,22,23)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377603
PNG
(6-chloro-3-{[(4- | US10266495, Compound I-15)
Show SMILES COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1S(C)(=O)=O
Show InChI InChI=1S/C18H17ClN2O4S/c1-25-16-9-14(4-6-17(16)26(2,23)24)20-10-12-7-11-8-13(19)3-5-15(11)21-18(12)22/h3-9,20H,10H2,1-2H3,(H,21,22)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377606
PNG
(3-({[3-methoxy-4-(4-methyl- | US10266495, Compound...)
Show SMILES COc1cc(NCc2cc3cc(C)ccc3[nH]c2=O)ccc1-n1cnc(C)c1
Show InChI InChI=1S/C22H22N4O2/c1-14-4-6-19-16(8-14)9-17(22(27)25-19)11-23-18-5-7-20(21(10-18)28-3)26-12-15(2)24-13-26/h4-10,12-13,23H,11H2,1-3H3,(H,25,27)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377614
PNG
(4-{[(6-fluoro-7-methoxy-2-oxo- | US10266495, Compo...)
Show SMILES COc1cc2[nH]c(=O)c(CNc3ccc(C#N)c(OC)c3)cc2cc1F
Show InChI InChI=1S/C19H16FN3O3/c1-25-17-7-14(4-3-11(17)9-21)22-10-13-5-12-6-15(20)18(26-2)8-16(12)23-19(13)24/h3-8,22H,10H2,1-2H3,(H,23,24)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377651
PNG
(4-({[6-chloro-7-(oxan-4-ylmethoxy)-2-oxo-1,2- | US...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC4CCOCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H24ClN3O4/c1-30-22-10-19(3-2-16(22)12-26)27-13-18-8-17-9-20(25)23(11-21(17)28-24(18)29)32-14-15-4-6-31-7-5-15/h2-3,8-11,15,27H,4-7,13-14H2,1H3,(H,28,29)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377657
PNG
(4-[({6-chloro-7-[2-(morpholin-4-yl)-2-oxoethoxy]-2...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC(=O)N4CCOCC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H23ClN4O5/c1-32-21-10-18(3-2-15(21)12-26)27-13-17-8-16-9-19(25)22(11-20(16)28-24(17)31)34-14-23(30)29-4-6-33-7-5-29/h2-3,8-11,27H,4-7,13-14H2,1H3,(H,28,31)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377600
PNG
(6-chloro-3-({[4-(1H-imidazol-1- | US10266495, Comp...)
Show SMILES COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1-n1ccnc1
Show InChI InChI=1S/C20H17ClN4O2/c1-27-19-10-16(3-5-18(19)25-7-6-22-12-25)23-11-14-8-13-9-15(21)2-4-17(13)24-20(14)26/h2-10,12,23H,11H2,1H3,(H,24,26)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377604
PNG
(3-({[3-methoxy-4-(1H-1,2,3,4- | US10266495, Compou...)
Show SMILES COc1cc(NCc2cc3cc(C)ccc3[nH]c2=O)ccc1-n1cnnn1
Show InChI InChI=1S/C19H18N6O2/c1-12-3-5-16-13(7-12)8-14(19(26)22-16)10-20-15-4-6-17(18(9-15)27-2)25-11-21-23-24-25/h3-9,11,20H,10H2,1-2H3,(H,22,26)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377613
PNG
(2-methoxy-4-({[2-oxo-6- | US10266495, Compound I-2...)
Show SMILES COc1cc(NCc2cc3cc(ccc3[nH]c2=O)C(F)(F)F)ccc1C#N
Show InChI InChI=1S/C19H14F3N3O2/c1-27-17-8-15(4-2-11(17)9-23)24-10-13-6-12-7-14(19(20,21)22)3-5-16(12)25-18(13)26/h2-8,24H,10H2,1H3,(H,25,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377618
PNG
(4-{[(7-hydroxy-2-oxo-1,2- | US10266495, Compound I...)
Show SMILES COc1cc(NCc2cc3ccc(O)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C18H15N3O3/c1-24-17-7-14(4-2-12(17)9-19)20-10-13-6-11-3-5-15(22)8-16(11)21-18(13)23/h2-8,20,22H,10H2,1H3,(H,21,23)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377621
PNG
(6-chloro-3-({[3-methoxy-4-(1H-1,2,3,4-tetrazol-1- ...)
Show SMILES COc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1-n1cnnn1
Show InChI InChI=1S/C18H15ClN6O2/c1-27-17-8-14(3-5-16(17)25-10-21-23-24-25)20-9-12-6-11-7-13(19)2-4-15(11)22-18(12)26/h2-8,10,20H,9H2,1H3,(H,22,26)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377637
PNG
(3-({[4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]amino}meth...)
Show SMILES O=c1[nH]c2ccccc2cc1CNc1ccc(cc1)-n1cnnn1
Show InChI InChI=1S/C17H14N6O/c24-17-13(9-12-3-1-2-4-16(12)20-17)10-18-14-5-7-15(8-6-14)23-11-19-21-22-23/h1-9,11,18H,10H2,(H,20,24)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377653
PNG
(4-[({6-chloro-2-oxo-7-[(3S)-oxolan-3-ylmethoxy]-1,...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OC[C@H]4CCOC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1/C23H22ClN3O4/c1-29-21-8-18(3-2-15(21)10-25)26-11-17-6-16-7-19(24)22(9-20(16)27-23(17)28)31-13-14-4-5-30-12-14/h2-3,6-9,14,26H,4-5,11-13H2,1H3,(H,27,28)/t14-/s2
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377654
PNG
(4-[({6-chloro-7-[(1-methylpiperidin-4-yl)oxy]-2-ox...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OC4CCN(C)CC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H25ClN4O3/c1-29-7-5-19(6-8-29)32-23-12-21-16(10-20(23)25)9-17(24(30)28-21)14-27-18-4-3-15(13-26)22(11-18)31-2/h3-4,9-12,19,27H,5-8,14H2,1-2H3,(H,28,30)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377655
PNG
(2-[(6-chloro-3-{[(4-cyano-3- | US10266495, Compoun...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCC(=O)N(C)C)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C22H21ClN4O4/c1-27(2)21(28)12-31-20-9-18-14(7-17(20)23)6-15(22(29)26-18)11-25-16-5-4-13(10-24)19(8-16)30-3/h4-9,25H,11-12H2,1-3H3,(H,26,29)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377662
PNG
(4-({[6-chloro-2-oxo-7-(pyridin-4-ylmethoxy)-1,2- |...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCc4ccncc4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H19ClN4O3/c1-31-22-10-19(3-2-16(22)12-26)28-13-18-8-17-9-20(25)23(11-21(17)29-24(18)30)32-14-15-4-6-27-7-5-15/h2-11,28H,13-14H2,1H3,(H,29,30)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377676
PNG
(4-[({6-chloro-7-[2-(4-methylpiperazin-1-yl)ethoxy]...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCN4CCN(C)CC4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C25H28ClN5O3/c1-30-5-7-31(8-6-30)9-10-34-24-14-22-18(12-21(24)26)11-19(25(32)29-22)16-28-20-4-3-17(15-27)23(13-20)33-2/h3-4,11-14,28H,5-10,16H2,1-2H3,(H,29,32)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377677
PNG
(4-[({6-chloro-7-[2-(1H-imidazol-1-yl)ethoxy]-2-oxo...)
Show SMILES COc1cc(NCc2cc3cc(Cl)c(OCCn4ccnc4)cc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C23H20ClN5O3/c1-31-21-10-18(3-2-15(21)12-25)27-13-17-8-16-9-19(24)22(11-20(16)28-23(17)30)32-7-6-29-5-4-26-14-29/h2-5,8-11,14,27H,6-7,13H2,1H3,(H,28,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377686
PNG
(4-({[6-chloro-2-oxo-8- | US10266495, Compound I-98)
Show SMILES COc1cc(NCc2cc3cc(Cl)cc(OCc4ccccn4)c3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C24H19ClN4O3/c1-31-21-11-19(6-5-15(21)12-26)28-13-17-8-16-9-18(25)10-22(23(16)29-24(17)30)32-14-20-4-2-3-7-27-20/h2-11,28H,13-14H2,1H3,(H,29,30)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132H


(Homo sapiens (Human))
BDBM377594
PNG
(6-chloro-3-[(1S)-1-[(4- | US10266495, Compound I-6)
Show SMILES COc1cc(N[C@@H](C)c2cc3cc(Cl)ccc3[nH]c2=O)ccc1S(C)(=O)=O
Show InChI InChI=1/C19H19ClN2O4S/c1-11(15-9-12-8-13(20)4-6-16(12)22-19(15)23)21-14-5-7-18(27(3,24)25)17(10-14)26-2/h4-11,21H,1-3H3,(H,22,23)/t11-/s2
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377596
PNG
(4-{[(6-chloro-2-oxo-1,2- | US10266495, Compound I-...)
Show SMILES Oc1cc(NCc2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N
Show InChI InChI=1S/C17H12ClN3O2/c18-13-2-4-15-11(6-13)5-12(17(23)21-15)9-20-14-3-1-10(8-19)16(22)7-14/h1-7,20,22H,9H2,(H,21,23)
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SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
IDH1 R132C


(Homo sapiens (Human))
BDBM377620
PNG
(4-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3- | US102...)
Show SMILES Clc1ccc2cc(CNc3ccc(cc3)C#N)c(=O)[nH]c2c1
Show InChI InChI=1S/C17H12ClN3O/c18-14-4-3-12-7-13(17(22)21-16(12)8-14)10-20-15-5-1-11(9-19)2-6-15/h1-8,20H,10H2,(H,21,22)
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n/an/a>1.00E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM377695
PNG
(US10266496, Example 7)
Show SMILES OC(=O)c1ccc(cc1O)-c1cc(cc2cc[nH]c12)C#N
Show InChI InChI=1S/C16H10N2O3/c17-8-9-5-11-3-4-18-15(11)13(6-9)10-1-2-12(16(20)21)14(19)7-10/h1-7,18-19H,(H,20,21)
KEGG

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n/an/a 2.88E+3n/an/an/an/an/an/a



SUNSHINE LAKE PHARMA CO., LTD.

US Patent


Assay Description
a. Construction of a Cell Line Stably Expressing hURAT1hURAT1 plasmid was transfected into HEK293T cell, and a cell line stably expressing hURAT1 was...


US Patent US10266496 (2019)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%