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Patent code US9738637

Compile Data Set for Download or QSAR

Found 297 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
Lysine-specific demethylase 4A


(Homo sapiens (Human))
BDBM320446
PNG
(2-(3,4-difluorobenzyl)-1H- pyrrolo[3,2-b]pyridine-...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(F)c(F)c3)[nH]c12
Show InChI InChI=1S/C15H10F2N2O2/c16-11-2-1-8(6-12(11)17)5-9-7-13-14(19-9)10(15(20)21)3-4-18-13/h1-4,6-7,19H,5H2,(H,20,21)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2A was determined in 384-well plate format under the following reaction conditions: 2 nM...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320433
PNG
(2-[(4-fluorophenyl)methyl]- pyrrolo[3,2-b]pyridine...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(F)cc3)[nH]c12
Show InChI InChI=1S/C15H11FN2O2/c16-10-3-1-9(2-4-10)7-11-8-13-14(18-11)12(15(19)20)5-6-17-13/h1-6,8,18H,7H2,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320445
PNG
(2-[(2,2-dimethylpyrrolidinyl)- carbonyl]pyrrolo[3,...)
Show SMILES CC1(C)CCCN1C(=O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C15H17N3O3/c1-15(2)5-3-7-18(15)13(19)11-8-10-12(17-11)9(14(20)21)4-6-16-10/h4,6,8,17H,3,5,7H2,1-2H3,(H,20,21)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320453
PNG
(2-[4-chloro-3-(trifluoro-methoxy)benzyl]-1H-pyrrol...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(OC(F)(F)F)c3)[nH]c12
Show InChI InChI=1S/C16H10ClF3N2O3/c17-11-2-1-8(6-13(11)25-16(18,19)20)5-9-7-12-14(22-9)10(15(23)24)3-4-21-12/h1-4,6-7,22H,5H2,(H,23,24)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320376
PNG
(2-(1-hydroxyethyl)-1H- pyrrolo[3,2-b]pyridine-7- c...)
Show SMILES CC(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C10H10N2O3/c1-5(13)7-4-8-9(12-7)6(10(14)15)2-3-11-8/h2-5,12-13H,1H3,(H,14,15)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320393
PNG
(2-(phenoxymethyl)-1H- pyrrolo[3,2-b]pyridine-7- ca...)
Show SMILES OC(=O)c1ccnc2cc(COc3ccccc3)[nH]c12
Show InChI InChI=1S/C15H12N2O3/c18-15(19)12-6-7-16-13-8-10(17-14(12)13)9-20-11-4-2-1-3-5-11/h1-8,17H,9H2,(H,18,19)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320405
PNG
(2-[(4-fluorophenoxy)methyl]-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc(COc3ccc(F)cc3)[nH]c12
Show InChI InChI=1S/C15H11FN2O3/c16-9-1-3-11(4-2-9)21-8-10-7-13-14(18-10)12(15(19)20)5-6-17-13/h1-7,18H,8H2,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320407
PNG
(2-[(4-chlorophenoxy)methyl]-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc(COc3ccc(Cl)cc3)[nH]c12
Show InChI InChI=1S/C15H11ClN2O3/c16-9-1-3-11(4-2-9)21-8-10-7-13-14(18-10)12(15(19)20)5-6-17-13/h1-7,18H,8H2,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320408
PNG
(2-[(2-methylphenoxy)methyl]- 1H-pyrrolo[3,2-b]pyri...)
Show SMILES Cc1ccccc1OCc1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C16H14N2O3/c1-10-4-2-3-5-14(10)21-9-11-8-13-15(18-11)12(16(19)20)6-7-17-13/h2-8,18H,9H2,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320412
PNG
(2-[(3-methylphenoxy)methyl]- 1H-pyrrolo[3,2-b]pyri...)
Show SMILES Cc1cccc(OCc2cc3nccc(C(O)=O)c3[nH]2)c1
Show InChI InChI=1S/C16H14N2O3/c1-10-3-2-4-12(7-10)21-9-11-8-14-15(18-11)13(16(19)20)5-6-17-14/h2-8,18H,9H2,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320414
PNG
(2-[(2-chlorophenyl)methyl]-1H- pyrrolo[3,2-b]pyrid...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccccc3Cl)[nH]c12
Show InChI InChI=1S/C15H11ClN2O2/c16-12-4-2-1-3-9(12)7-10-8-13-14(18-10)11(15(19)20)5-6-17-13/h1-6,8,18H,7H2,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320417
PNG
(2-[(3,5-difluorophenoxy)methyl]- 1H-pyrrolo[3,2-b]...)
Show SMILES OC(=O)c1ccnc2cc(COc3cc(F)cc(F)c3)[nH]c12
Show InChI InChI=1S/C15H10F2N2O3/c16-8-3-9(17)5-11(4-8)22-7-10-6-13-14(19-10)12(15(20)21)1-2-18-13/h1-6,19H,7H2,(H,20,21)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320418
PNG
(2-[(3,5-dimethylphenoxy)- methyl]-1H-pyrrolo[3,2-b...)
Show SMILES Cc1cc(C)cc(OCc2cc3nccc(C(O)=O)c3[nH]2)c1
Show InChI InChI=1S/C17H16N2O3/c1-10-5-11(2)7-13(6-10)22-9-12-8-15-16(19-12)14(17(20)21)3-4-18-15/h3-8,19H,9H2,1-2H3,(H,20,21)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320421
PNG
(2-(1-phenoxybutyl)-1H- pyrrolo[3,2-b]pyridine-7- c...)
Show SMILES CCCC(Oc1ccccc1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C18H18N2O3/c1-2-6-16(23-12-7-4-3-5-8-12)14-11-15-17(20-14)13(18(21)22)9-10-19-15/h3-5,7-11,16,20H,2,6H2,1H3,(H,21,22)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320423
PNG
(2-[(2-chlorophenyl)-propoxy- methyl]-1H-pyrrolo[3,...)
Show SMILES CCCOC(c1cc2nccc(C(O)=O)c2[nH]1)c1ccccc1Cl
Show InChI InChI=1S/C18H17ClN2O3/c1-2-9-24-17(11-5-3-4-6-13(11)19)15-10-14-16(21-15)12(18(22)23)7-8-20-14/h3-8,10,17,21H,2,9H2,1H3,(H,22,23)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320424
PNG
(2-[(2,4-dichlorophenyl)methyl]- 1H-pyrrolo[3,2-b]p...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(Cl)cc3Cl)[nH]c12
Show InChI InChI=1S/C15H10Cl2N2O2/c16-9-2-1-8(12(17)6-9)5-10-7-13-14(19-10)11(15(20)21)3-4-18-13/h1-4,6-7,19H,5H2,(H,20,21)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320433
PNG
(2-[(4-fluorophenyl)methyl]- pyrrolo[3,2-b]pyridine...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(F)cc3)[nH]c12
Show InChI InChI=1S/C15H11FN2O2/c16-10-3-1-9(2-4-10)7-11-8-13-14(18-11)12(15(19)20)5-6-17-13/h1-6,8,18H,7H2,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320452
PNG
(2-[4-chloro-3-(cyclopropyl- methoxy)benzyl]-1H-pyr...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(OCC4CC4)c3)[nH]c12
Show InChI InChI=1S/C19H17ClN2O3/c20-15-4-3-12(8-17(15)25-10-11-1-2-11)7-13-9-16-18(22-13)14(19(23)24)5-6-21-16/h3-6,8-9,11,22H,1-2,7,10H2,(H,23,24)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320384
PNG
(2-(1-hydroxycyclopentyl)-1H- pyrrolo[3,2-b]pyridin...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C1(O)CCCC1
Show InChI InChI=1S/C13H14N2O3/c16-12(17)8-3-6-14-9-7-10(15-11(8)9)13(18)4-1-2-5-13/h3,6-7,15,18H,1-2,4-5H2,(H,16,17)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320388
PNG
(2-(1-hydroxy-2-methylpropyl)- 1H-pyrrolo[3,2-b]pyr...)
Show SMILES CC(C)C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C12H14N2O3/c1-6(2)11(15)9-5-8-10(14-9)7(12(16)17)3-4-13-8/h3-6,11,14-15H,1-2H3,(H,16,17)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320390
PNG
(2-[(3-methoxyphenyl)methyl]- 1H-pyrrolo[3,2-b]pyri...)
Show SMILES COc1cccc(Cc2cc3nccc(C(O)=O)c3[nH]2)c1
Show InChI InChI=1S/C16H14N2O3/c1-21-12-4-2-3-10(8-12)7-11-9-14-15(18-11)13(16(19)20)5-6-17-14/h2-6,8-9,18H,7H2,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320392
PNG
(2-(2-cyclopropyl-1- hydroxyethyl)-1H-pyrrolo- [3,2...)
Show SMILES OC(CC1CC1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C13H14N2O3/c16-11(5-7-1-2-7)9-6-10-12(15-9)8(13(17)18)3-4-14-10/h3-4,6-7,11,15-16H,1-2,5H2,(H,17,18)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320392
PNG
(2-(2-cyclopropyl-1- hydroxyethyl)-1H-pyrrolo- [3,2...)
Show SMILES OC(CC1CC1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C13H14N2O3/c16-11(5-7-1-2-7)9-6-10-12(15-9)8(13(17)18)3-4-14-10/h3-4,6-7,11,15-16H,1-2,5H2,(H,17,18)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320394
PNG
(2-(methoxymethyl)-1H- pyrrolo[3,2-b]pyridine-7- ca...)
Show SMILES COCc1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C10H10N2O3/c1-15-5-6-4-8-9(12-6)7(10(13)14)2-3-11-8/h2-4,12H,5H2,1H3,(H,13,14)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320399
PNG
(2-(cyclopentylmethyl)-1H- pyrrolo[3,2-b]pyridine- ...)
Show SMILES OC(=O)c1ccnc2cc(CC3CCCC3)[nH]c12
Show InChI InChI=1S/C14H16N2O2/c17-14(18)11-5-6-15-12-8-10(16-13(11)12)7-9-3-1-2-4-9/h5-6,8-9,16H,1-4,7H2,(H,17,18)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320404
PNG
(2-[(4-methoxyphenyl)methyl]- 1H-pyrrolo[3,2-b]pyri...)
Show SMILES COc1ccc(Cc2cc3nccc(C(O)=O)c3[nH]2)cc1
Show InChI InChI=1S/C16H14N2O3/c1-21-12-4-2-10(3-5-12)8-11-9-14-15(18-11)13(16(19)20)6-7-17-14/h2-7,9,18H,8H2,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320414
PNG
(2-[(2-chlorophenyl)methyl]-1H- pyrrolo[3,2-b]pyrid...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccccc3Cl)[nH]c12
Show InChI InChI=1S/C15H11ClN2O2/c16-12-4-2-1-3-9(12)7-10-8-13-14(18-10)11(15(19)20)5-6-17-13/h1-6,8,18H,7H2,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320420
PNG
(2-(1-phenoxyethyl)-1H- pyrrolo[3,2-b]pyridine-7- c...)
Show SMILES CC(Oc1ccccc1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C16H14N2O3/c1-10(21-11-5-3-2-4-6-11)13-9-14-15(18-13)12(16(19)20)7-8-17-14/h2-10,18H,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320423
PNG
(2-[(2-chlorophenyl)-propoxy- methyl]-1H-pyrrolo[3,...)
Show SMILES CCCOC(c1cc2nccc(C(O)=O)c2[nH]1)c1ccccc1Cl
Show InChI InChI=1S/C18H17ClN2O3/c1-2-9-24-17(11-5-3-4-6-13(11)19)15-10-14-16(21-15)12(18(22)23)7-8-20-14/h3-8,10,17,21H,2,9H2,1H3,(H,22,23)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320440
PNG
(2-(4-chloro-3-fluorobenzyl)-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(F)c3)[nH]c12
Show InChI InChI=1S/C15H10ClFN2O2/c16-11-2-1-8(6-12(11)17)5-9-7-13-14(19-9)10(15(20)21)3-4-18-13/h1-4,6-7,19H,5H2,(H,20,21)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320447
PNG
(2-(4-chloro-3-methoxybenzyl)- 1H-pyrrolo[3,2-b]pyr...)
Show SMILES COc1cc(Cc2cc3nccc(C(O)=O)c3[nH]2)ccc1Cl
Show InChI InChI=1S/C16H13ClN2O3/c1-22-14-7-9(2-3-12(14)17)6-10-8-13-15(19-10)11(16(20)21)4-5-18-13/h2-5,7-8,19H,6H2,1H3,(H,20,21)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320452
PNG
(2-[4-chloro-3-(cyclopropyl- methoxy)benzyl]-1H-pyr...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(Cl)c(OCC4CC4)c3)[nH]c12
Show InChI InChI=1S/C19H17ClN2O3/c20-15-4-3-12(8-17(15)25-10-11-1-2-11)7-13-9-16-18(22-13)14(19(23)24)5-6-21-16/h3-6,8-9,11,22H,1-2,7,10H2,(H,23,24)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320369
PNG
(2-cyclopropyl-1H-pyrrolo- [3,2-b]pyridine-7-carbox...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C1CC1
Show InChI InChI=1S/C11H10N2O2/c14-11(15)7-3-4-12-9-5-8(6-1-2-6)13-10(7)9/h3-6,13H,1-2H2,(H,14,15)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320370
PNG
(2-(2-hydroxypropan-2-yl)-1H- pyrrolo[3,2-b]pyridin...)
Show SMILES CC(C)(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C11H12N2O3/c1-11(2,16)8-5-7-9(13-8)6(10(14)15)3-4-12-7/h3-5,13,16H,1-2H3,(H,14,15)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320379
PNG
(2-[hydroxy-(3-methyl- phenyl)methyl]-1H-pyrrolo[3,...)
Show SMILES Cc1cccc(c1)C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C16H14N2O3/c1-9-3-2-4-10(7-9)15(19)13-8-12-14(18-13)11(16(20)21)5-6-17-12/h2-8,15,18-19H,1H3,(H,20,21)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320380
PNG
(2-[hydroxy-(3- methoxyphenyl)methyl]-1H- pyrrolo[3...)
Show SMILES COc1cccc(c1)C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C16H14N2O4/c1-22-10-4-2-3-9(7-10)15(19)13-8-12-14(18-13)11(16(20)21)5-6-17-12/h2-8,15,18-19H,1H3,(H,20,21)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320392
PNG
(2-(2-cyclopropyl-1- hydroxyethyl)-1H-pyrrolo- [3,2...)
Show SMILES OC(CC1CC1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C13H14N2O3/c16-11(5-7-1-2-7)9-6-10-12(15-9)8(13(17)18)3-4-14-10/h3-4,6-7,11,15-16H,1-2,5H2,(H,17,18)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320398
PNG
(2-[hydroxy-(2-methylpyrazol-3- yl)methyl]-1H-pyrro...)
Show SMILES Cn1nccc1C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C13H12N4O3/c1-17-10(3-5-15-17)12(18)9-6-8-11(16-9)7(13(19)20)2-4-14-8/h2-6,12,16,18H,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320398
PNG
(2-[hydroxy-(2-methylpyrazol-3- yl)methyl]-1H-pyrro...)
Show SMILES Cn1nccc1C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C13H12N4O3/c1-17-10(3-5-15-17)12(18)9-6-8-11(16-9)7(13(19)20)2-4-14-8/h2-6,12,16,18H,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320401
PNG
(2-[hydroxy-(1-methylpyrazol-4- yl)methyl]-1H-pyrro...)
Show SMILES Cn1ccc(n1)C(O)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C13H12N4O3/c1-17-5-3-8(16-17)12(18)10-6-9-11(15-10)7(13(19)20)2-4-14-9/h2-6,12,15,18H,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320405
PNG
(2-[(4-fluorophenoxy)methyl]-1H- pyrrolo[3,2-b]pyri...)
Show SMILES OC(=O)c1ccnc2cc(COc3ccc(F)cc3)[nH]c12
Show InChI InChI=1S/C15H11FN2O3/c16-9-1-3-11(4-2-9)21-8-10-7-13-14(18-10)12(15(19)20)5-6-17-13/h1-7,18H,8H2,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320409
PNG
(2-[[4-(trifluoromethyl)- phenoxy]methyl]-1H-pyrrol...)
Show SMILES OC(=O)c1ccnc2cc(COc3ccc(cc3)C(F)(F)F)[nH]c12
Show InChI InChI=1S/C16H11F3N2O3/c17-16(18,19)9-1-3-11(4-2-9)24-8-10-7-13-14(21-10)12(15(22)23)5-6-20-13/h1-7,21H,8H2,(H,22,23)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320410
PNG
(2-(2-phenylethyl)-1H- pyrrolo[3,2-b]pyridine-7- ca...)
Show SMILES OC(=O)c1ccnc2cc(CCc3ccccc3)[nH]c12
Show InChI InChI=1S/C16H14N2O2/c19-16(20)13-8-9-17-14-10-12(18-15(13)14)7-6-11-4-2-1-3-5-11/h1-5,8-10,18H,6-7H2,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320412
PNG
(2-[(3-methylphenoxy)methyl]- 1H-pyrrolo[3,2-b]pyri...)
Show SMILES Cc1cccc(OCc2cc3nccc(C(O)=O)c3[nH]2)c1
Show InChI InChI=1S/C16H14N2O3/c1-10-3-2-4-12(7-10)21-9-11-8-14-15(18-11)13(16(19)20)5-6-17-14/h2-8,18H,9H2,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320420
PNG
(2-(1-phenoxyethyl)-1H- pyrrolo[3,2-b]pyridine-7- c...)
Show SMILES CC(Oc1ccccc1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C16H14N2O3/c1-10(21-11-5-3-2-4-6-11)13-9-14-15(18-13)12(16(19)20)7-8-17-14/h2-10,18H,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320420
PNG
(2-(1-phenoxyethyl)-1H- pyrrolo[3,2-b]pyridine-7- c...)
Show SMILES CC(Oc1ccccc1)c1cc2nccc(C(O)=O)c2[nH]1
Show InChI InChI=1S/C16H14N2O3/c1-10(21-11-5-3-2-4-6-11)13-9-14-15(18-13)12(16(19)20)7-8-17-14/h2-10,18H,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320426
PNG
(2-[(4-methoxyphenoxy)methyl]- 1H-pyrrolo[3,2-b]pyr...)
Show SMILES COc1ccc(OCc2cc3nccc(C(O)=O)c3[nH]2)cc1
Show InChI InChI=1S/C16H14N2O4/c1-21-11-2-4-12(5-3-11)22-9-10-8-14-15(18-10)13(16(19)20)6-7-17-14/h2-8,18H,9H2,1H3,(H,19,20)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320434
PNG
(2-[1-(4-fluorophenyl)-1- hydroxyethyl]-1H-pyrrolo[...)
Show SMILES CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1
Show InChI InChI=1S/C16H13FN2O3/c1-16(22,9-2-4-10(17)5-3-9)13-8-12-14(19-13)11(15(20)21)6-7-18-12/h2-8,19,22H,1H3,(H,20,21)
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MMDB

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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320444
PNG
(2-(2-1,2,3,4-tetrahydro- isoquinolylcarbonyl)pyrro...)
Show SMILES OC(=O)c1ccnc2cc([nH]c12)C(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C18H15N3O3/c22-17(21-8-6-11-3-1-2-4-12(11)10-21)15-9-14-16(20-15)13(18(23)24)5-7-19-14/h1-5,7,9,20H,6,8,10H2,(H,23,24)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9738637 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320446
PNG
(2-(3,4-difluorobenzyl)-1H- pyrrolo[3,2-b]pyridine-...)
Show SMILES OC(=O)c1ccnc2cc(Cc3ccc(F)c(F)c3)[nH]c12
Show InChI InChI=1S/C15H10F2N2O2/c16-11-2-1-8(6-12(11)17)5-9-7-13-14(19-9)10(15(20)21)3-4-18-13/h1-4,6-7,19H,5H2,(H,20,21)
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Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9738637 (2017)

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