BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 358 hits Enz. Inhib. hit(s) with Target = 'p110β/p85α'   
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
p110β/p85α


(Homo sapiens (Human))
BDBM50192880
PNG
(CHEMBL3984425 | US10329299, Compound 21 | US977584...)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H24N8O2/c1-19(34-29(39)26-27(31)35-37-15-7-14-32-28(26)37)24-16-22-9-6-8-21(13-12-20-17-33-36(2)18-20)25(22)30(40)38(24)23-10-4-3-5-11-23/h3-11,14-19H,1-2H3,(H2,31,35)(H,34,39)/t19-/s2
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 82n/an/an/an/an/a



Infinity Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant full length N-terminal His6-tagged PI3K p110beta/p85alpha coexpressed in baculovirus infected Sf9 insect cells ...


ACS Med Chem Lett 7: 862-7 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00238
BindingDB Entry DOI: 10.7270/Q2N018HX
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50240324
PNG
(CHEMBL4067552)
Show SMILES Nc1ncc(cn1)-c1cn2c3CCN(Cc3nc2c(n1)N1CCOCC1)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C25H26FN9O2/c26-18-3-1-16(2-4-18)11-30-25(36)34-6-5-21-20(14-34)32-23-22(33-7-9-37-10-8-33)31-19(15-35(21)23)17-12-28-24(27)29-13-17/h1-4,12-13,15H,5-11,14H2,(H,30,36)(H2,27,28,29)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
43n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His6-tagged p110beta/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf2...


Bioorg Med Chem Lett 27: 2536-2543 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.090
BindingDB Entry DOI: 10.7270/Q2N87CZ1
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50451425
PNG
(CHEMBL4212439)
Show SMILES CS(=O)(=O)N1CCN(Cc2cc3c(nc(cn3n2)-c2cnc(N)nc2)N2CCOCC2)CC1
Show InChI InChI=1S/C20H27N9O3S/c1-33(30,31)28-4-2-26(3-5-28)13-16-10-18-19(27-6-8-32-9-7-27)24-17(14-29(18)25-16)15-11-22-20(21)23-12-15/h10-12,14H,2-9,13H2,1H3,(H2,21,22,23)
PDB

GoogleScholar
UniChem
PubMed
49n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of p110beta/85alpha (unknown origin) using PIP2 as substrate by HTRF assay


Bioorg Med Chem Lett 27: 4794-4799 (2017)

More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50240317
PNG
(CHEMBL4070339)
Show SMILES Nc1ncc(cn1)-c1cn2c3CCN(CCc4ccc(F)cc4)Cc3nc2c(n1)N1CCOCC1
Show InChI InChI=1S/C25H27FN8O/c26-19-3-1-17(2-4-19)5-7-32-8-6-22-21(15-32)31-24-23(33-9-11-35-12-10-33)30-20(16-34(22)24)18-13-28-25(27)29-14-18/h1-4,13-14,16H,5-12,15H2,(H2,27,28,29)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
54n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His6-tagged p110beta/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf2...


Bioorg Med Chem Lett 27: 2536-2543 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.090
BindingDB Entry DOI: 10.7270/Q2N87CZ1
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50240322
PNG
(CHEMBL4098032)
Show SMILES Nc1ncc(cn1)-c1cn2c3CN(CCc3nc2c(n1)N1CCOCC1)S(=O)(=O)C1CC1
Show InChI InChI=1S/C20H24N8O3S/c21-20-22-9-13(10-23-20)16-11-28-17-12-27(32(29,30)14-1-2-14)4-3-15(17)24-19(28)18(25-16)26-5-7-31-8-6-26/h9-11,14H,1-8,12H2,(H2,21,22,23)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
66n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His6-tagged p110beta/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf2...


Bioorg Med Chem Lett 27: 2536-2543 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.090
BindingDB Entry DOI: 10.7270/Q2N87CZ1
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50451427
PNG
(CHEMBL4212973)
Show SMILES CS(=O)(=O)N1CCN(Cc2cc3c(nc(c(Cl)n3n2)-c2cnc(N)nc2)N2CCOCC2)CC1
Show InChI InChI=1S/C20H26ClN9O3S/c1-34(31,32)29-4-2-27(3-5-29)13-15-10-16-19(28-6-8-33-9-7-28)25-17(18(21)30(16)26-15)14-11-23-20(22)24-12-14/h10-12H,2-9,13H2,1H3,(H2,22,23,24)
PDB

GoogleScholar
UniChem
PubMed
72n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of p110beta/85alpha (unknown origin) using PIP2 as substrate by HTRF assay


Bioorg Med Chem Lett 27: 4794-4799 (2017)

More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50451423
PNG
(CHEMBL4217392)
Show SMILES CS(=O)(=O)N1CCN(Cc2nc3c(nc(cn3n2)-c2cnc(N)nc2)N2CCOCC2)CC1
Show InChI InChI=1S/C19H26N10O3S/c1-33(30,31)28-4-2-26(3-5-28)13-16-24-18-17(27-6-8-32-9-7-27)23-15(12-29(18)25-16)14-10-21-19(20)22-11-14/h10-12H,2-9,13H2,1H3,(H2,20,21,22)
PDB

GoogleScholar
UniChem
PubMed
155n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of p110beta/85alpha (unknown origin) using PIP2 as substrate by HTRF assay


Bioorg Med Chem Lett 27: 4794-4799 (2017)

More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50420714
PNG
(CHEMBL2087474)
Show SMILES CS(=O)(=O)N1CCN(Cc2cn3cc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CC1
Show InChI InChI=1S/C20H27N9O3S/c1-33(30,31)29-4-2-26(3-5-29)12-16-13-28-14-17(15-10-22-20(21)23-11-15)25-19(18(28)24-16)27-6-8-32-9-7-27/h10-11,13-14H,2-9,12H2,1H3,(H2,21,22,23)
PDB

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
170n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His6-tagged p110beta/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf2...


Bioorg Med Chem Lett 27: 2536-2543 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.090
BindingDB Entry DOI: 10.7270/Q2N87CZ1
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50420714
PNG
(CHEMBL2087474)
Show SMILES CS(=O)(=O)N1CCN(Cc2cn3cc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CC1
Show InChI InChI=1S/C20H27N9O3S/c1-33(30,31)29-4-2-26(3-5-29)12-16-13-28-14-17(15-10-22-20(21)23-11-15)25-19(18(28)24-16)27-6-8-32-9-7-27/h10-11,13-14H,2-9,12H2,1H3,(H2,21,22,23)
PDB

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
170n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of p110beta/85alpha (unknown origin) using PIP2 as substrate by HTRF assay


Bioorg Med Chem Lett 27: 4794-4799 (2017)

More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50240326
PNG
(CHEMBL4068727)
Show SMILES CS(=O)(=O)N1CCc2c(C1)nc1c(nc(cn21)-c1cnc(N)nc1)N1CCOCC1
Show InChI InChI=1S/C18H22N8O3S/c1-30(27,28)25-3-2-15-14(10-25)23-17-16(24-4-6-29-7-5-24)22-13(11-26(15)17)12-8-20-18(19)21-9-12/h8-9,11H,2-7,10H2,1H3,(H2,19,20,21)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
253n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His6-tagged p110beta/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf2...


Bioorg Med Chem Lett 27: 2536-2543 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.090
BindingDB Entry DOI: 10.7270/Q2N87CZ1
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50451424
PNG
(CHEMBL4205584)
Show SMILES CS(=O)(=O)N1CCN(Cc2nc3c(nc(-c4cnc(N)nc4)c(Cl)n3n2)N2CCOCC2)CC1
Show InChI InChI=1S/C19H25ClN10O3S/c1-34(31,32)29-4-2-27(3-5-29)12-14-24-18-17(28-6-8-33-9-7-28)25-15(16(20)30(18)26-14)13-10-22-19(21)23-11-13/h10-11H,2-9,12H2,1H3,(H2,21,22,23)
PDB

GoogleScholar
UniChem
PubMed
285n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of p110beta/85alpha (unknown origin) using PIP2 as substrate by HTRF assay


Bioorg Med Chem Lett 27: 4794-4799 (2017)

More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50451426
PNG
(CHEMBL4208064)
Show SMILES CS(=O)(=O)N1CCN(Cc2cn3nc(nc(N4CCOCC4)c3n2)-c2cnc(N)nc2)CC1
Show InChI InChI=1S/C19H26N10O3S/c1-33(30,31)28-4-2-26(3-5-28)12-15-13-29-18(23-15)17(27-6-8-32-9-7-27)24-16(25-29)14-10-21-19(20)22-11-14/h10-11,13H,2-9,12H2,1H3,(H2,20,21,22)
PDB

GoogleScholar
UniChem
PubMed
388n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of p110beta/85alpha (unknown origin) using PIP2 as substrate by HTRF assay


Bioorg Med Chem Lett 27: 4794-4799 (2017)

More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50240318
PNG
(CHEMBL4083480)
Show SMILES CS(=O)(=O)NCCN1CCc2c(C1)nc1c(nc(cn21)-c1cnc(N)nc1)N1CCOCC1
Show InChI InChI=1S/C20H27N9O3S/c1-33(30,31)24-3-5-27-4-2-17-16(12-27)26-19-18(28-6-8-32-9-7-28)25-15(13-29(17)19)14-10-22-20(21)23-11-14/h10-11,13,24H,2-9,12H2,1H3,(H2,21,22,23)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>490n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His6-tagged p110beta/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf2...


Bioorg Med Chem Lett 27: 2536-2543 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.090
BindingDB Entry DOI: 10.7270/Q2N87CZ1
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50240325
PNG
(CHEMBL4102709)
Show SMILES Nc1ncc(cn1)-c1cn2c3CCN(Cc3nc2c(n1)N1CCOCC1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C24H31N9O2/c25-23-26-12-16(13-27-23)18-15-33-20-6-7-32(24(34)28-17-4-2-1-3-5-17)14-19(20)30-22(33)21(29-18)31-8-10-35-11-9-31/h12-13,15,17H,1-11,14H2,(H,28,34)(H2,25,26,27)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>490n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His6-tagged p110beta/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf2...


Bioorg Med Chem Lett 27: 2536-2543 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.090
BindingDB Entry DOI: 10.7270/Q2N87CZ1
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50240323
PNG
(CHEMBL4062315)
Show SMILES Nc1ncc(cn1)-c1cn2c3CN(CCc3nc2c(n1)N1CCOCC1)S(=O)(=O)c1ccc(F)cc1
Show InChI InChI=1S/C23H23FN8O3S/c24-16-1-3-17(4-2-16)36(33,34)31-6-5-18-20(14-31)32-13-19(15-11-26-23(25)27-12-15)29-21(22(32)28-18)30-7-9-35-10-8-30/h1-4,11-13H,5-10,14H2,(H2,25,26,27)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>490n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His6-tagged p110beta/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf2...


Bioorg Med Chem Lett 27: 2536-2543 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.090
BindingDB Entry DOI: 10.7270/Q2N87CZ1
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50240320
PNG
(CHEMBL4088855)
Show SMILES Nc1ncc(cn1)-c1cn2c3CCN(Cc3nc2c(n1)N1CCOCC1)c1ccc(F)cc1
Show InChI InChI=1S/C23H23FN8O/c24-16-1-3-17(4-2-16)31-6-5-20-19(13-31)29-22-21(30-7-9-33-10-8-30)28-18(14-32(20)22)15-11-26-23(25)27-12-15/h1-4,11-12,14H,5-10,13H2,(H2,25,26,27)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>490n/an/an/an/an/an/an/an/a



Spanish National Cancer Research Centre (CNIO)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human N-terminal His6-tagged p110beta/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf2...


Bioorg Med Chem Lett 27: 2536-2543 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.090
BindingDB Entry DOI: 10.7270/Q2N87CZ1
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM25028
PNG
(4-[2-(1H-indazol-4-yl)-6-[(4-methanesulfonylpipera...)
Show SMILES CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
Show InChI InChI=1S/C23H27N7O3S2/c1-35(31,32)30-7-5-28(6-8-30)15-16-13-20-21(34-16)23(29-9-11-33-12-10-29)26-22(25-20)17-3-2-4-19-18(17)14-24-27-19/h2-4,13-14H,5-12,15H2,1H3,(H,24,27)
PDB

GoogleScholar
Purchase

CHEBI
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
n/an/a 33n/an/an/an/a7.522



Piramed Pharma



Assay Description
Test compounds were added to reaction buffer containing yttrium silicate (Ysi) polylysine SPA beads (Amersham), and the enzyme was added to the assay...


J Med Chem 51: 5522-32 (2008)


Article DOI: 10.1021/jm800295d
BindingDB Entry DOI: 10.7270/Q2222S23
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
p110β/p85α


(Homo sapiens (Human))
BDBM25082
PNG
(3-(2,4-diamino-pteridin-6-yl)-phenol | 3-(2,4-diam...)
Show SMILES Nc1nc(N)c2nc(cnc2n1)-c1cccc(O)c1
Show InChI InChI=1S/C12H10N6O/c13-10-9-11(18-12(14)17-10)15-5-8(16-9)6-2-1-3-7(19)4-6/h1-5,19H,(H4,13,14,15,17,18)
PDB

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 215n/an/an/an/a7.422



TargeGen Inc



Assay Description
The luminescence-based kinase assay with recombinant phosphatidylinositol 3-kinase (Upstate Cell Signaling Solutions) was used for the determination ...


Proc Natl Acad Sci U S A 103: 19866-71 (2006)


Article DOI: 10.1073/pnas.0606956103
BindingDB Entry DOI: 10.7270/Q2J101GM
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM25083
PNG
(6-(1H-indol-4-yl)-pteridin-2,4-diamine | 6-(1H-ind...)
Show SMILES Nc1nc(N)c2nc(cnc2n1)-c1cccc2[nH]ccc12
Show InChI InChI=1S/C14H11N7/c15-12-11-13(21-14(16)20-12)18-6-10(19-11)7-2-1-3-9-8(7)4-5-17-9/h1-6,17H,(H4,15,16,18,20,21)
PDB

GoogleScholar
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 107n/an/an/an/a7.422



TargeGen Inc



Assay Description
The luminescence-based kinase assay with recombinant phosphatidylinositol 3-kinase (Upstate Cell Signaling Solutions) was used for the determination ...


Proc Natl Acad Sci U S A 103: 19866-71 (2006)


Article DOI: 10.1073/pnas.0606956103
BindingDB Entry DOI: 10.7270/Q2J101GM
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM25084
PNG
(3-[2,4-diamino-6-(3-hydroxyphenyl)pteridin-7-yl]ph...)
Show SMILES Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
Show InChI InChI=1S/C18H14N6O2/c19-16-15-17(24-18(20)23-16)22-14(10-4-2-6-12(26)8-10)13(21-15)9-3-1-5-11(25)7-9/h1-8,25-26H,(H4,19,20,22,23,24)
PDB

GoogleScholar
Purchase

PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.20E+3n/an/an/an/a7.422



TargeGen Inc



Assay Description
The luminescence-based kinase assay with recombinant phosphatidylinositol 3-kinase (Upstate Cell Signaling Solutions) was used for the determination ...


Proc Natl Acad Sci U S A 103: 19866-71 (2006)


Article DOI: 10.1073/pnas.0606956103
BindingDB Entry DOI: 10.7270/Q2J101GM
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM12915
PNG
(2-(4-Morpholinyl)-8-phenyl-4H-1-benzopyran-4-one |...)
Show SMILES O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2
PDB

GoogleScholar
Purchase

CHEBI
CHEMBL
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 858n/an/an/an/a7.422



TargeGen Inc



Assay Description
The luminescence-based kinase assay with recombinant phosphatidylinositol 3-kinase (Upstate Cell Signaling Solutions) was used for the determination ...


Proc Natl Acad Sci U S A 103: 19866-71 (2006)


Article DOI: 10.1073/pnas.0606956103
BindingDB Entry DOI: 10.7270/Q2J101GM
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM15234
PNG
((1R,3R,5S,9R,18S)-18-(methoxymethyl)-1,5-dimethyl-...)
Show SMILES COC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C([C@@H]2CCC(=O)[C@@]2(C)C[C@H]1OC(C)=O)C3=O
Show InChI InChI=1/C23H24O8/c1-10(24)30-13-7-22(2)12(5-6-14(22)25)16-18(13)23(3)15(9-28-4)31-21(27)11-8-29-20(17(11)23)19(16)26/h8,12-13,15H,5-7,9H2,1-4H3/t12-,13+,15+,22-,23-/s2
PDB

GoogleScholar
Purchase

CHEBI
CHEMBL
DrugBank
KEGG
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
n/an/a 1.47E+8n/an/an/an/a7.422



TargeGen Inc



Assay Description
The luminescence-based kinase assay with recombinant phosphatidylinositol 3-kinase (Upstate Cell Signaling Solutions) was used for the determination ...


Proc Natl Acad Sci U S A 103: 19866-71 (2006)


Article DOI: 10.1073/pnas.0606956103
BindingDB Entry DOI: 10.7270/Q2J101GM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
p110β/p85α


(Homo sapiens (Human))
BDBM25084
PNG
(3-[2,4-diamino-6-(3-hydroxyphenyl)pteridin-7-yl]ph...)
Show SMILES Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
Show InChI InChI=1S/C18H14N6O2/c19-16-15-17(24-18(20)23-16)22-14(10-4-2-6-12(26)8-10)13(21-15)9-3-1-5-11(25)7-9/h1-8,25-26H,(H4,19,20,22,23,24)
PDB

GoogleScholar
Purchase

PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.20E+3n/an/an/an/a7.422



TargeGen Inc



Assay Description
The luminescence-based kinase assay with recombinant phosphatidylinositol 3-kinase (Upstate Cell Signaling Solutions) was used for the determination ...


J Med Chem 50: 4279-94 (2007)


Article DOI: 10.1021/jm051056c
BindingDB Entry DOI: 10.7270/Q2D798QW
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM259445
PNG
(US9512114, 4)
Show SMILES C[C@H](Nc1ncnc(N)c1-c1nnc(C)o1)c1cc2cccc(Cl)c2c(=O)n1C1CC1
Show InChI InChI=1/C21H20ClN7O2/c1-10(26-19-17(18(23)24-9-25-19)20-28-27-11(2)31-20)15-8-12-4-3-5-14(22)16(12)21(30)29(15)13-6-7-13/h3-5,8-10,13H,6-7H2,1-2H3,(H3,23,24,25,26)/t10-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 30n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p1103/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4, 5-bisphosphate and MgATP (concentration as requ...


US Patent US9512114 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4PWS
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM259446
PNG
(US9512114, 5 | US9657007, Example 5)
Show SMILES CC[C@H](Nc1ncnc(N)c1-c1nnc(C)o1)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C25H22ClN7O2/c1-3-18(30-23-21(22(27)28-13-29-23)24-32-31-14(2)35-24)19-12-15-8-7-11-17(26)20(15)25(34)33(19)16-9-5-4-6-10-16/h4-13,18H,3H2,1-2H3,(H3,27,28,29,30)/t18-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 259n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p1103/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4, 5-bisphosphate and MgATP (concentration as requ...


US Patent US9512114 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4PWS
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM259449
PNG
(US9512114, 8 | US9657007, Example 8)
Show SMILES C[C@H](Nc1ncnc(N)c1-c1nc(C)no1)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C24H20ClN7O2/c1-13(29-22-20(21(26)27-12-28-22)23-30-14(2)31-34-23)18-11-15-7-6-10-17(25)19(15)24(33)32(18)16-8-4-3-5-9-16/h3-13H,1-2H3,(H3,26,27,28,29)/t13-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 33n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p1103/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4, 5-bisphosphate and MgATP (concentration as requ...


US Patent US9512114 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4PWS
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM259450
PNG
(US9512114, 9 | US9657007, Example 9)
Show SMILES C[C@H](Nc1ncnc(N)c1-c1nnc(C)o1)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C24H20ClN7O2/c1-13(29-22-20(21(26)27-12-28-22)23-31-30-14(2)34-23)18-11-15-7-6-10-17(25)19(15)24(33)32(18)16-8-4-3-5-9-16/h3-13H,1-2H3,(H3,26,27,28,29)/t13-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 226n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p1103/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4, 5-bisphosphate and MgATP (concentration as requ...


US Patent US9512114 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4PWS
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM259451
PNG
(US9512114, 11 | US9657007, Example 11)
Show SMILES C[C@H](Nc1ncnc(N)c1-c1noc(C)n1)c1cc2cccc(Cl)c2c(=O)n1C1CC1
Show InChI InChI=1/C21H20ClN7O2/c1-10(26-19-17(18(23)24-9-25-19)20-27-11(2)31-28-20)15-8-12-4-3-5-14(22)16(12)21(30)29(15)13-6-7-13/h3-5,8-10,13H,6-7H2,1-2H3,(H3,23,24,25,26)/t10-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 102n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p1103/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4, 5-bisphosphate and MgATP (concentration as requ...


US Patent US9512114 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4PWS
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM259459
PNG
(US9512114, 24 | US9657007, Example 24)
Show SMILES C[C@H](Nc1ncnc(N)c1-c1nc(C)no1)c1cc2cccc(Cl)c2c(=O)n1C1CC1
Show InChI InChI=1/C21H20ClN7O2/c1-10(26-19-17(18(23)24-9-25-19)20-27-11(2)28-31-20)15-8-12-4-3-5-14(22)16(12)21(30)29(15)13-6-7-13/h3-5,8-10,13H,6-7H2,1-2H3,(H3,23,24,25,26)/t10-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 38n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p1103/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4, 5-bisphosphate and MgATP (concentration as requ...


US Patent US9512114 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4PWS
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM259460
PNG
(US9512114, 25)
Show SMILES C[C@H](Nc1ncnc(N)c1-c1nnc(C)o1)c1cc2cccc(-c3cnn(C)c3)c2c(=O)n1C1CC1
Show InChI InChI=1/C25H25N9O2/c1-13(30-23-21(22(26)27-12-28-23)24-32-31-14(2)36-24)19-9-15-5-4-6-18(16-10-29-33(3)11-16)20(15)25(35)34(19)17-7-8-17/h4-6,9-13,17H,7-8H2,1-3H3,(H3,26,27,28,30)/t13-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 900n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p1103/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4, 5-bisphosphate and MgATP (concentration as requ...


US Patent US9512114 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4PWS
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM259461
PNG
(US9512114, 26)
Show SMILES C[C@H](Nc1ncnc(N)c1-c1nc(C)no1)c1cc2cccc(-c3cnn(C)c3)c2c(=O)n1C1CC1
Show InChI InChI=1/C25H25N9O2/c1-13(30-23-21(22(26)27-12-28-23)24-31-14(2)32-36-24)19-9-15-5-4-6-18(16-10-29-33(3)11-16)20(15)25(35)34(19)17-7-8-17/h4-6,9-13,17H,7-8H2,1-3H3,(H3,26,27,28,30)/t13-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 176n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p1103/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4, 5-bisphosphate and MgATP (concentration as requ...


US Patent US9512114 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4PWS
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM259462
PNG
(US9512114, 27)
Show SMILES C[C@H](Nc1ncnc(N)c1-c1nnc(C)o1)c1cc2cccc(-c3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C28H25N9O2/c1-16(33-26-24(25(29)30-15-31-26)27-35-34-17(2)39-27)22-12-18-8-7-11-21(19-13-32-36(3)14-19)23(18)28(38)37(22)20-9-5-4-6-10-20/h4-16H,1-3H3,(H3,29,30,31,33)/t16-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a>3.00E+3n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p1103/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4, 5-bisphosphate and MgATP (concentration as requ...


US Patent US9512114 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4PWS
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM259463
PNG
(US9512114, 28)
Show SMILES C[C@H](Nc1ncnc(N)c1-c1nc(C)no1)c1cc2cccc(-c3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C28H25N9O2/c1-16(33-26-24(25(29)30-15-31-26)27-34-17(2)35-39-27)22-12-18-8-7-11-21(19-13-32-36(3)14-19)23(18)28(38)37(22)20-9-5-4-6-10-20/h4-16H,1-3H3,(H3,29,30,31,33)/t16-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 1.17E+3n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p1103/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4, 5-bisphosphate and MgATP (concentration as requ...


US Patent US9512114 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4PWS
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50117874
PNG
(CHEMBL3612310)
Show SMILES CCN(CC)CCNC(=O)Nc1nc2ccc(cc2s1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2)c1
Show InChI InChI=1S/C26H29FN6O4S2/c1-4-33(5-2)13-12-28-25(34)31-26-30-21-11-6-17(15-23(21)38-26)18-14-22(24(37-3)29-16-18)32-39(35,36)20-9-7-19(27)8-10-20/h6-11,14-16,32H,4-5,12-13H2,1-3H3,(H2,28,30,31,34)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 90n/an/an/an/an/an/a



Xi'an Jiaotong University

Curated by ChEMBL


Assay Description
Inhibition of p110beta/p85alpha (unknown origin) incubated for 40 mins by luciferase based ATP depletion assay


Bioorg Med Chem 23: 6477-85 (2015)


Article DOI: 10.1016/j.bmc.2015.08.013
BindingDB Entry DOI: 10.7270/Q24J0GX8
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM92862
PNG
(US9284315, BEZ-235 | mTOR Inhibitor, BEZ235)
Show SMILES Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1cnc2ccccc2c1
Show InChI InChI=1S/C30H23N5O/c1-30(2,18-31)22-9-11-23(12-10-22)35-28-24-15-19(21-14-20-6-4-5-7-25(20)32-16-21)8-13-26(24)33-17-27(28)34(3)29(35)36/h4-17H,1-3H3
PDB

GoogleScholar
Purchase

CHEBI
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 478n/an/an/an/an/an/a



Xi'an Jiaotong University

Curated by ChEMBL


Assay Description
Inhibition of p110beta/p85alpha (unknown origin) incubated for 40 mins by luciferase based ATP depletion assay


Bioorg Med Chem 23: 6477-85 (2015)


Article DOI: 10.1016/j.bmc.2015.08.013
BindingDB Entry DOI: 10.7270/Q24J0GX8
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50175003
PNG
(CHEMBL3808812)
Show SMILES CCN1CCN(CC1)c1cc(F)c(NC(=O)N2CCc3c2nc(nc3-c2cnc(N)nc2)N2CCOCC2)c(F)c1
Show InChI InChI=1S/C27H32F2N10O2/c1-2-36-5-7-37(8-6-36)18-13-20(28)23(21(29)14-18)34-27(40)39-4-3-19-22(17-15-31-25(30)32-16-17)33-26(35-24(19)39)38-9-11-41-12-10-38/h13-16H,2-12H2,1H3,(H,34,40)(H2,30,31,32)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7n/an/an/an/an/an/a



Chugai Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of human PI3K p110beta/p85alpha expressed in baculovirus preincubated for 20 mins followed by addition of phosphorylate phosphatidylinosit...


Bioorg Med Chem 24: 2897-2906 (2016)


Article DOI: 10.1016/j.bmc.2016.04.060
BindingDB Entry DOI: 10.7270/Q21J9CQT
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM50192880
PNG
(CHEMBL3984425 | US10329299, Compound 21 | US977584...)
Show SMILES C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(C#Cc3cnn(C)c3)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C30H24N8O2/c1-19(34-29(39)26-27(31)35-37-15-7-14-32-28(26)37)24-16-22-9-6-8-21(13-12-20-17-33-36(2)18-20)25(22)30(40)38(24)23-10-4-3-5-11-23/h3-11,14-19H,1-2H3,(H2,31,35)(H,34,39)/t19-/s2
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.50E+3n/an/an/an/an/an/a



Infinity Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibition of human recombinant full length N-terminal His6-tagged PI3K p110beta/p85alpha coexpressed in baculovirus infected Sf9 insect cells using ...


ACS Med Chem Lett 7: 862-7 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00238
BindingDB Entry DOI: 10.7270/Q2N018HX
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM188117
PNG
(US9670194, Ex. 2 (S)-2-(1-((6-amino-5-(5-methyl-1,...)
Show SMILES CC[C@H](Nc1ncnc(N)c1-c1nnc(C)o1)c1nc2cccc(Cl)c2c(=O)n1C1CC1
Show InChI InChI=1/C21H21ClN8O2/c1-3-13(26-18-16(17(23)24-9-25-18)20-29-28-10(2)32-20)19-27-14-6-4-5-12(22)15(14)21(31)30(19)11-7-8-11/h4-6,9,11,13H,3,7-8H2,1-2H3,(H3,23,24,25,26)/t13-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 168n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p110β/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4,5-bisphosphate and MgATP (concentration as ...


US Patent US9670194 (2017)


BindingDB Entry DOI: 10.7270/Q2NS0S1D
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM188124
PNG
(US9670194, Ex. 3 (S)-2-(1-((6-amino-5-(3-methyl-1,...)
Show SMILES CC[C@H](Nc1ncnc(N)c1-c1nc(C)no1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C24H21ClN8O2/c1-3-16(30-21-19(20(26)27-12-28-21)23-29-13(2)32-35-23)22-31-17-11-7-10-15(25)18(17)24(34)33(22)14-8-5-4-6-9-14/h4-12,16H,3H2,1-2H3,(H3,26,27,28,30)/t16-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 142n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p110β/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4,5-bisphosphate and MgATP (concentration as ...


US Patent US9670194 (2017)


BindingDB Entry DOI: 10.7270/Q2NS0S1D
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM188145
PNG
(US9670194, Ex. 4 (S)-2-(1-((6-amino-5-(3-methyl-1,...)
Show SMILES CC[C@H](Nc1ncnc(N)c1-c1nc(C)no1)c1nc2cccc(Cl)c2c(=O)n1C1CC1
Show InChI InChI=1/C21H21ClN8O2/c1-3-13(27-18-16(17(23)24-9-25-18)20-26-10(2)29-32-20)19-28-14-6-4-5-12(22)15(14)21(31)30(19)11-7-8-11/h4-6,9,11,13H,3,7-8H2,1-2H3,(H3,23,24,25,27)/t13-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 113n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p110β/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4,5-bisphosphate and MgATP (concentration as ...


US Patent US9670194 (2017)


BindingDB Entry DOI: 10.7270/Q2NS0S1D
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM188324
PNG
(US9670194, Ex. 6 2-((S)-1((6-amino-5-((S)-4-methyl...)
Show SMILES CC[C@H](Nc1ncnc(N)c1C1=N[C@@H](C)CO1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C25H24ClN7O2/c1-3-17(31-22-20(21(27)28-13-29-22)24-30-14(2)12-35-24)23-32-18-11-7-10-16(26)19(18)25(34)33(23)15-8-5-4-6-9-15/h4-11,13-14,17H,3,12H2,1-2H3,(H3,27,28,29,31)/t14-,17-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a>3.00E+3n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p110β/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4,5-bisphosphate and MgATP (concentration as ...


US Patent US9670194 (2017)


BindingDB Entry DOI: 10.7270/Q2NS0S1D
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM188325
PNG
(US9670194, Ex. 7 (S)-2-(1-((6-amino-5-(5-methyloxa...)
Show SMILES CC[C@H](Nc1ncnc(N)c1-c1ncc(C)o1)c1nc2cccc(Cl)c2c(=O)n1C1CC1
Show InChI InChI=1/C22H22ClN7O2/c1-3-14(28-19-17(18(24)26-10-27-19)21-25-9-11(2)32-21)20-29-15-6-4-5-13(23)16(15)22(31)30(20)12-7-8-12/h4-6,9-10,12,14H,3,7-8H2,1-2H3,(H3,24,26,27,28)/t14-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 2.78E+3n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p110β/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4,5-bisphosphate and MgATP (concentration as ...


US Patent US9670194 (2017)


BindingDB Entry DOI: 10.7270/Q2NS0S1D
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM188328
PNG
(US9670194, Ex. 10 2-((1S)-1-((6-amino-5-(1-methyl-...)
Show SMILES CC[C@H](Nc1ncnc(N)c1-c1ncnn1C)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1
Show InChI InChI=1/C24H22ClN9O/c1-3-16(31-21-19(20(26)27-12-28-21)23-29-13-30-33(23)2)22-32-17-11-7-10-15(25)18(17)24(35)34(22)14-8-5-4-6-9-14/h4-13,16H,3H2,1-2H3,(H3,26,27,28,31)/t16-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a>3.00E+3n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p110β/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4,5-bisphosphate and MgATP (concentration as ...


US Patent US9670194 (2017)


BindingDB Entry DOI: 10.7270/Q2NS0S1D
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM188329
PNG
(US9670194, Ex. 11 (S)-2-(1-((6-amino-5-(pyridin-2-...)
Show SMILES CC[C@H](Nc1ncnc(N)c1-c1ccccn1)c1nc2cccc(Cl)c2c(=O)n1C1CC1
Show InChI InChI=1/C23H22ClN7O/c1-2-15(29-21-19(20(25)27-12-28-21)16-7-3-4-11-26-16)22-30-17-8-5-6-14(24)18(17)23(32)31(22)13-9-10-13/h3-8,11-13,15H,2,9-10H2,1H3,(H3,25,27,28,29)/t15-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a>3.00E+3n/an/an/an/an/a25



CALITOR SCIENCES, LLC

US Patent


Assay Description
PI3K (p110β/p85α) (h) is incubated in assay buffer containing 10 μM phosphatidylinositol-4,5-bisphosphate and MgATP (concentration as ...


US Patent US9670194 (2017)


BindingDB Entry DOI: 10.7270/Q2NS0S1D
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM139715
PNG
(US8895549, Comparative Example 1 | US9675616, 1 N-...)
Show SMILES COc1c(OCC(O)CN2CCOCC2)ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc12
Show InChI InChI=1/C24H28N6O5/c1-33-21-19(35-15-17(31)14-29-9-11-34-12-10-29)5-4-18-20(21)27-24(30-8-7-26-22(18)30)28-23(32)16-3-2-6-25-13-16/h2-6,13,17,31H,7-12,14-15H2,1H3,(H,27,28,32)
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>50n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
For the assay 50 nL of a 80-fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384-well microtiter plate (G...


US Patent US9675616 (2017)


BindingDB Entry DOI: 10.7270/Q2H41PKX
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM139717
PNG
(US8895549, 2 | US9675616, 2 N-(8-{[(2R)-2-hydroxy-...)
Show SMILES COc1c(OC[C@H](O)CN2CCOCC2)ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc12
Show InChI InChI=1/C24H28N6O5/c1-33-21-19(35-15-17(31)14-29-9-11-34-12-10-29)5-4-18-20(21)27-24(30-8-7-26-22(18)30)28-23(32)16-3-2-6-25-13-16/h2-6,13,17,31H,7-12,14-15H2,1H3,(H,27,28,32)/t17-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 30n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
For the assay 50 nL of a 80-fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384-well microtiter plate (G...


US Patent US9675616 (2017)


BindingDB Entry DOI: 10.7270/Q2H41PKX
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM139721
PNG
(US8895549, 3 | US9675616, 3 N-(8-{[(2S)-2-hydroxy-...)
Show SMILES COc1c(OC[C@@H](O)CN2CCOCC2)ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc12
Show InChI InChI=1/C24H28N6O5/c1-33-21-19(35-15-17(31)14-29-9-11-34-12-10-29)5-4-18-20(21)27-24(30-8-7-26-22(18)30)28-23(32)16-3-2-6-25-13-16/h2-6,13,17,31H,7-12,14-15H2,1H3,(H,27,28,32)/t17-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a>50n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
For the assay 50 nL of a 80-fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384-well microtiter plate (G...


US Patent US9675616 (2017)


BindingDB Entry DOI: 10.7270/Q2H41PKX
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM179448
PNG
(US9675616, 5 rel-2-Amino-N-(8-{[(2R)-2-hydroxy-3-{...)
Show SMILES COc1c(OCC(O)CN[C@@H](C)c2ccccc2)ccc2C3=NCCN3C(NC(=O)c3cnc(N)nc3)=Nc12
Show InChI InChI=1/C27H30N8O4/c1-16(17-6-4-3-5-7-17)30-14-19(36)15-39-21-9-8-20-22(23(21)38-2)33-27(35-11-10-29-24(20)35)34-25(37)18-12-31-26(28)32-13-18/h3-9,12-13,16,19,30,36H,10-11,14-15H2,1-2H3,(H2,28,31,32)(H,33,34,37)/t16-,19?/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
For the assay 50 nL of a 80-fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384-well microtiter plate (G...


US Patent US9675616 (2017)


BindingDB Entry DOI: 10.7270/Q2H41PKX
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM179449
PNG
(US9675616, 6 2-Amino-N-(8-{[(2S)-2-hydroxy-3-{[(1S...)
Show SMILES COc1c(OC[C@@H](O)CN[C@@H](C)c2ccccc2)ccc2C3=NCCN3C(NC(=O)c3cnc(N)nc3)=Nc12
Show InChI InChI=1/C27H30N8O4/c1-16(17-6-4-3-5-7-17)30-14-19(36)15-39-21-9-8-20-22(23(21)38-2)33-27(35-11-10-29-24(20)35)34-25(37)18-12-31-26(28)32-13-18/h3-9,12-13,16,19,30,36H,10-11,14-15H2,1-2H3,(H2,28,31,32)(H,33,34,37)/t16-,19-/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
For the assay 50 nL of a 80-fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384-well microtiter plate (G...


US Patent US9675616 (2017)


BindingDB Entry DOI: 10.7270/Q2H41PKX
More data for this
Ligand-Target Pair
p110β/p85α


(Homo sapiens (Human))
BDBM179450
PNG
(US9675616, 7 2-Amino-N-(8-{[(2R)-2-hydroxy-3-{[(1S...)
Show SMILES COc1c(OC[C@H](O)CN[C@@H](C)c2ccccc2)ccc2C3=NCCN3C(NC(=O)c3cnc(N)nc3)=Nc12
Show InChI InChI=1/C27H30N8O4/c1-16(17-6-4-3-5-7-17)30-14-19(36)15-39-21-9-8-20-22(23(21)38-2)33-27(35-11-10-29-24(20)35)34-25(37)18-12-31-26(28)32-13-18/h3-9,12-13,16,19,30,36H,10-11,14-15H2,1-2H3,(H2,28,31,32)(H,33,34,37)/t16-,19+/s2
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



Bayer Intellectual Property GmbH

US Patent


Assay Description
For the assay 50 nL of a 80-fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384-well microtiter plate (G...


US Patent US9675616 (2017)


BindingDB Entry DOI: 10.7270/Q2H41PKX
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 358 total )  |  Next  |  Last  >>
Jump to: