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PubMed code 22981333

Compile data set for download or QSAR
Found 103 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
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392456
PNG
(CHEMBL2151926)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Cl
Show InChI InChI=1S/C16H16ClFN4O3/c17-11-7-10(1-2-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 2n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392457
PNG
(CHEMBL2151927)
Show SMILES COc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C17H19FN4O4/c1-25-13-8-11(2-3-12(13)18)19-16(23)9-14-20-15(10-17(24)21-14)22-4-6-26-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)(H,20,21,24)
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n/an/a 3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392453
PNG
(CHEMBL2151923)
Show SMILES Brc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17BrN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 5n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392455
PNG
(CHEMBL2151925)
Show SMILES Cc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C17H19FN4O3/c1-11-8-12(2-3-13(11)18)19-16(23)9-14-20-15(10-17(24)21-14)22-4-6-25-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)(H,20,21,24)
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n/an/a 6n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392469
PNG
(CHEMBL2151821)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Show InChI InChI=1S/C16H17FN4O3/c17-11-1-3-12(4-2-11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a 13n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392452
PNG
(CHEMBL2151922)
Show SMILES COc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C17H20N4O4/c1-24-13-4-2-3-12(9-13)18-16(22)10-14-19-15(11-17(23)20-14)21-5-7-25-8-6-21/h2-4,9,11H,5-8,10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a 15n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392449
PNG
(CHEMBL2151919)
Show SMILES Cc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C17H20N4O3/c1-12-3-2-4-13(9-12)18-16(22)10-14-19-15(11-17(23)20-14)21-5-7-24-8-6-21/h2-4,9,11H,5-8,10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a 17n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392458
PNG
(CHEMBL2151048)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Br
Show InChI InChI=1S/C16H16BrFN4O3/c17-11-7-10(1-2-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 26n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392451
PNG
(CHEMBL2151921)
Show SMILES Clc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17ClN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 33n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50389035
PNG
(CHEMBL2064419)
Show SMILES O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1ccccc1
Show InChI InChI=1S/C16H18N4O3/c21-15(17-12-4-2-1-3-5-12)10-13-18-14(11-16(22)19-13)20-6-8-23-9-7-20/h1-5,11H,6-10H2,(H,17,21)(H,18,19,22)
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n/an/a 42n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392466
PNG
(CHEMBL2151935)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(Cl)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18ClFN4O3/c1-22-14(9-16(24)20-11-2-3-13(19)12(18)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a 42n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392460
PNG
(CHEMBL2151929)
Show SMILES [O-][N+](=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C16H16FN5O5/c17-11-2-1-10(7-12(11)22(25)26)18-15(23)8-13-19-14(9-16(24)20-13)21-3-5-27-6-4-21/h1-2,7,9H,3-6,8H2,(H,18,23)(H,19,20,24)
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n/an/a 47n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392454
PNG
(CHEMBL2151924)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1F
Show InChI InChI=1S/C16H16F2N4O3/c17-11-2-1-10(7-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 53n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392455
PNG
(CHEMBL2151925)
Show SMILES Cc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C17H19FN4O3/c1-11-8-12(2-3-13(11)18)19-16(23)9-14-20-15(10-17(24)21-14)22-4-6-25-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)(H,20,21,24)
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n/an/a 63n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392468
PNG
(CHEMBL2151820)
Show SMILES Fc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17FN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 81n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392469
PNG
(CHEMBL2151821)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Show InChI InChI=1S/C16H17FN4O3/c17-11-1-3-12(4-2-11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a 86n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392465
PNG
(CHEMBL2151934)
Show SMILES COc1cc(NC(=O)Cc2nc(cc(=O)n2C)N2CCOCC2)ccc1F
Show InChI InChI=1S/C18H21FN4O4/c1-22-15(21-16(11-18(22)25)23-5-7-27-8-6-23)10-17(24)20-12-3-4-13(19)14(9-12)26-2/h3-4,9,11H,5-8,10H2,1-2H3,(H,20,24)
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n/an/a 104n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50389035
PNG
(CHEMBL2064419)
Show SMILES O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1ccccc1
Show InChI InChI=1S/C16H18N4O3/c21-15(17-12-4-2-1-3-5-12)10-13-18-14(11-16(22)19-13)20-6-8-23-9-7-20/h1-5,11H,6-10H2,(H,17,21)(H,18,19,22)
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n/an/a 118n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392454
PNG
(CHEMBL2151924)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1F
Show InChI InChI=1S/C16H16F2N4O3/c17-11-2-1-10(7-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 135n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392456
PNG
(CHEMBL2151926)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Cl
Show InChI InChI=1S/C16H16ClFN4O3/c17-11-7-10(1-2-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 137n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392467
PNG
(CHEMBL2151819)
Show SMILES Fc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Show InChI InChI=1S/C16H17FN4O3/c17-11-3-1-2-4-12(11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a 142n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392457
PNG
(CHEMBL2151927)
Show SMILES COc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C17H19FN4O4/c1-25-13-8-11(2-3-12(13)18)19-16(23)9-14-20-15(10-17(24)21-14)22-4-6-26-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)(H,20,21,24)
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n/an/a 148n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392449
PNG
(CHEMBL2151919)
Show SMILES Cc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C17H20N4O3/c1-12-3-2-4-13(9-12)18-16(22)10-14-19-15(11-17(23)20-14)21-5-7-24-8-6-21/h2-4,9,11H,5-8,10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a 164n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392459
PNG
(CHEMBL2151928)
Show SMILES COC(=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C18H19FN4O5/c1-27-18(26)12-8-11(2-3-13(12)19)20-16(24)9-14-21-15(10-17(25)22-14)23-4-6-28-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)(H,21,22,25)
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n/an/a 175n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392453
PNG
(CHEMBL2151923)
Show SMILES Brc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17BrN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 189n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392470
PNG
(CHEMBL2151822)
Show SMILES Cc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Show InChI InChI=1S/C17H20N4O3/c1-12-4-2-3-5-13(12)18-16(22)10-14-19-15(11-17(23)20-14)21-6-8-24-9-7-21/h2-5,11H,6-10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a 236n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392462
PNG
(CHEMBL2151931)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)cc2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H19FN4O3/c1-21-14(10-16(23)19-13-4-2-12(18)3-5-13)20-15(11-17(21)24)22-6-8-25-9-7-22/h2-5,11H,6-10H2,1H3,(H,19,23)
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n/an/a 244n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392463
PNG
(CHEMBL2151932)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(F)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18F2N4O3/c1-22-14(9-16(24)20-11-2-3-12(18)13(19)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a 262n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392451
PNG
(CHEMBL2151921)
Show SMILES Clc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17ClN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 278n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392458
PNG
(CHEMBL2151048)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Br
Show InChI InChI=1S/C16H16BrFN4O3/c17-11-7-10(1-2-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 297n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392464
PNG
(CHEMBL2151933)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(Br)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18BrFN4O3/c1-22-14(9-16(24)20-11-2-3-13(19)12(18)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a 387n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392450
PNG
(CHEMBL2151920)
Show SMILES Clc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Show InChI InChI=1S/C16H17ClN4O3/c17-11-1-3-12(4-2-11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a 398n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50392461
PNG
(CHEMBL2151930)
Show SMILES Cn1c(CC(=O)Nc2ccccc2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H20N4O3/c1-20-14(11-16(22)18-13-5-3-2-4-6-13)19-15(12-17(20)23)21-7-9-24-10-8-21/h2-6,12H,7-11H2,1H3,(H,18,22)
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n/an/a 469n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392452
PNG
(CHEMBL2151922)
Show SMILES COc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C17H20N4O4/c1-24-13-4-2-3-12(9-13)18-16(22)10-14-19-15(11-17(23)20-14)21-5-7-25-8-6-21/h2-4,9,11H,5-8,10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a 611n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392449
PNG
(CHEMBL2151919)
Show SMILES Cc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C17H20N4O3/c1-12-3-2-4-13(9-12)18-16(22)10-14-19-15(11-17(23)20-14)21-5-7-24-8-6-21/h2-4,9,11H,5-8,10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a 626n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392455
PNG
(CHEMBL2151925)
Show SMILES Cc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C17H19FN4O3/c1-11-8-12(2-3-13(11)18)19-16(23)9-14-20-15(10-17(24)21-14)22-4-6-25-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)(H,20,21,24)
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n/an/a 831n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392468
PNG
(CHEMBL2151820)
Show SMILES Fc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17FN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 1.11E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392462
PNG
(CHEMBL2151931)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)cc2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H19FN4O3/c1-21-14(10-16(23)19-13-4-2-12(18)3-5-13)20-15(11-17(21)24)22-6-8-25-9-7-22/h2-5,11H,6-10H2,1H3,(H,19,23)
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n/an/a 1.47E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392463
PNG
(CHEMBL2151932)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(F)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18F2N4O3/c1-22-14(9-16(24)20-11-2-3-12(18)13(19)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a 1.77E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392456
PNG
(CHEMBL2151926)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Cl
Show InChI InChI=1S/C16H16ClFN4O3/c17-11-7-10(1-2-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392453
PNG
(CHEMBL2151923)
Show SMILES Brc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17BrN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 1.91E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50389035
PNG
(CHEMBL2064419)
Show SMILES O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1ccccc1
Show InChI InChI=1S/C16H18N4O3/c21-15(17-12-4-2-1-3-5-12)10-13-18-14(11-16(22)19-13)20-6-8-23-9-7-20/h1-5,11H,6-10H2,(H,17,21)(H,18,19,22)
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n/an/a 2.14E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392466
PNG
(CHEMBL2151935)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(Cl)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18ClFN4O3/c1-22-14(9-16(24)20-11-2-3-13(19)12(18)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a 2.21E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392464
PNG
(CHEMBL2151933)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(Br)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18BrFN4O3/c1-22-14(9-16(24)20-11-2-3-13(19)12(18)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a 2.22E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392450
PNG
(CHEMBL2151920)
Show SMILES Clc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Show InChI InChI=1S/C16H17ClN4O3/c17-11-1-3-12(4-2-11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a 2.27E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392452
PNG
(CHEMBL2151922)
Show SMILES COc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C17H20N4O4/c1-24-13-4-2-3-12(9-13)18-16(22)10-14-19-15(11-17(23)20-14)21-5-7-25-8-6-21/h2-4,9,11H,5-8,10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a 2.37E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392465
PNG
(CHEMBL2151934)
Show SMILES COc1cc(NC(=O)Cc2nc(cc(=O)n2C)N2CCOCC2)ccc1F
Show InChI InChI=1S/C18H21FN4O4/c1-22-15(21-16(11-18(22)25)23-5-7-27-8-6-23)10-17(24)20-12-3-4-13(19)14(9-12)26-2/h3-4,9,11H,5-8,10H2,1-2H3,(H,20,24)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392467
PNG
(CHEMBL2151819)
Show SMILES Fc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Show InChI InChI=1S/C16H17FN4O3/c17-11-3-1-2-4-12(11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a 2.45E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392451
PNG
(CHEMBL2151921)
Show SMILES Clc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17ClN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 2.55E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392450
PNG
(CHEMBL2151920)
Show SMILES Clc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Show InChI InChI=1S/C16H17ClN4O3/c17-11-1-3-12(4-2-11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a 2.78E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392469
PNG
(CHEMBL2151821)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Show InChI InChI=1S/C16H17FN4O3/c17-11-1-3-12(4-2-11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a 2.87E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392460
PNG
(CHEMBL2151929)
Show SMILES [O-][N+](=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C16H16FN5O5/c17-11-2-1-10(7-12(11)22(25)26)18-15(23)8-13-19-14(9-16(24)20-13)21-3-5-27-6-4-21/h1-2,7,9H,3-6,8H2,(H,18,23)(H,19,20,24)
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n/an/a 3.36E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392457
PNG
(CHEMBL2151927)
Show SMILES COc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C17H19FN4O4/c1-25-13-8-11(2-3-12(13)18)19-16(23)9-14-20-15(10-17(24)21-14)22-4-6-26-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)(H,20,21,24)
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n/an/a 3.46E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392454
PNG
(CHEMBL2151924)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1F
Show InChI InChI=1S/C16H16F2N4O3/c17-11-2-1-10(7-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 3.85E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392458
PNG
(CHEMBL2151048)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Br
Show InChI InChI=1S/C16H16BrFN4O3/c17-11-7-10(1-2-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 4.14E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392470
PNG
(CHEMBL2151822)
Show SMILES Cc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Show InChI InChI=1S/C17H20N4O3/c1-12-4-2-3-5-13(12)18-16(22)10-14-19-15(11-17(23)20-14)21-6-8-24-9-7-21/h2-5,11H,6-10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a 4.27E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392461
PNG
(CHEMBL2151930)
Show SMILES Cn1c(CC(=O)Nc2ccccc2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H20N4O3/c1-20-14(11-16(22)18-13-5-3-2-4-6-13)19-15(12-17(20)23)21-7-9-24-10-8-21/h2-6,12H,7-11H2,1H3,(H,18,22)
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n/an/a 4.29E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392460
PNG
(CHEMBL2151929)
Show SMILES [O-][N+](=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C16H16FN5O5/c17-11-2-1-10(7-12(11)22(25)26)18-15(23)8-13-19-14(9-16(24)20-13)21-3-5-27-6-4-21/h1-2,7,9H,3-6,8H2,(H,18,23)(H,19,20,24)
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n/an/a 4.35E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50392459
PNG
(CHEMBL2151928)
Show SMILES COC(=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C18H19FN4O5/c1-27-18(26)12-8-11(2-3-13(12)19)20-16(24)9-14-21-15(10-17(25)22-14)23-4-6-28-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)(H,21,22,25)
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n/an/a 4.65E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392450
PNG
(CHEMBL2151920)
Show SMILES Clc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Show InChI InChI=1S/C16H17ClN4O3/c17-11-1-3-12(4-2-11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a 5.09E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392468
PNG
(CHEMBL2151820)
Show SMILES Fc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17FN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 6.22E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392458
PNG
(CHEMBL2151048)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Br
Show InChI InChI=1S/C16H16BrFN4O3/c17-11-7-10(1-2-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 6.61E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392456
PNG
(CHEMBL2151926)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Cl
Show InChI InChI=1S/C16H16ClFN4O3/c17-11-7-10(1-2-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 6.71E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392449
PNG
(CHEMBL2151919)
Show SMILES Cc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C17H20N4O3/c1-12-3-2-4-13(9-12)18-16(22)10-14-19-15(11-17(23)20-14)21-5-7-24-8-6-21/h2-4,9,11H,5-8,10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a 7.07E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392464
PNG
(CHEMBL2151933)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(Br)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18BrFN4O3/c1-22-14(9-16(24)20-11-2-3-13(19)12(18)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a 7.61E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392455
PNG
(CHEMBL2151925)
Show SMILES Cc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C17H19FN4O3/c1-11-8-12(2-3-13(11)18)19-16(23)9-14-20-15(10-17(24)21-14)22-4-6-25-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)(H,20,21,24)
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n/an/a 8.01E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392459
PNG
(CHEMBL2151928)
Show SMILES COC(=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C18H19FN4O5/c1-27-18(26)12-8-11(2-3-13(12)19)20-16(24)9-14-21-15(10-17(25)22-14)23-4-6-28-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)(H,21,22,25)
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n/an/a 8.14E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392466
PNG
(CHEMBL2151935)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(Cl)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18ClFN4O3/c1-22-14(9-16(24)20-11-2-3-13(19)12(18)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a 8.28E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392463
PNG
(CHEMBL2151932)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(F)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18F2N4O3/c1-22-14(9-16(24)20-11-2-3-12(18)13(19)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a 8.51E+3n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392467
PNG
(CHEMBL2151819)
Show SMILES Fc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Show InChI InChI=1S/C16H17FN4O3/c17-11-3-1-2-4-12(11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392470
PNG
(CHEMBL2151822)
Show SMILES Cc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Show InChI InChI=1S/C17H20N4O3/c1-12-4-2-3-5-13(12)18-16(22)10-14-19-15(11-17(23)20-14)21-6-8-24-9-7-21/h2-5,11H,6-10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50389035
PNG
(CHEMBL2064419)
Show SMILES O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1ccccc1
Show InChI InChI=1S/C16H18N4O3/c21-15(17-12-4-2-1-3-5-12)10-13-18-14(11-16(22)19-13)20-6-8-23-9-7-20/h1-5,11H,6-10H2,(H,17,21)(H,18,19,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392465
PNG
(CHEMBL2151934)
Show SMILES COc1cc(NC(=O)Cc2nc(cc(=O)n2C)N2CCOCC2)ccc1F
Show InChI InChI=1S/C18H21FN4O4/c1-22-15(21-16(11-18(22)25)23-5-7-27-8-6-23)10-17(24)20-12-3-4-13(19)14(9-12)26-2/h3-4,9,11H,5-8,10H2,1-2H3,(H,20,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392459
PNG
(CHEMBL2151928)
Show SMILES COC(=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C18H19FN4O5/c1-27-18(26)12-8-11(2-3-13(12)19)20-16(24)9-14-21-15(10-17(25)22-14)23-4-6-28-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)(H,21,22,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392454
PNG
(CHEMBL2151924)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1F
Show InChI InChI=1S/C16H16F2N4O3/c17-11-2-1-10(7-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392469
PNG
(CHEMBL2151821)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Show InChI InChI=1S/C16H17FN4O3/c17-11-1-3-12(4-2-11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392467
PNG
(CHEMBL2151819)
Show SMILES Fc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Show InChI InChI=1S/C16H17FN4O3/c17-11-3-1-2-4-12(11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392465
PNG
(CHEMBL2151934)
Show SMILES COc1cc(NC(=O)Cc2nc(cc(=O)n2C)N2CCOCC2)ccc1F
Show InChI InChI=1S/C18H21FN4O4/c1-22-15(21-16(11-18(22)25)23-5-7-27-8-6-23)10-17(24)20-12-3-4-13(19)14(9-12)26-2/h3-4,9,11H,5-8,10H2,1-2H3,(H,20,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392464
PNG
(CHEMBL2151933)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(Br)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18BrFN4O3/c1-22-14(9-16(24)20-11-2-3-13(19)12(18)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392462
PNG
(CHEMBL2151931)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)cc2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H19FN4O3/c1-21-14(10-16(23)19-13-4-2-12(18)3-5-13)20-15(11-17(21)24)22-6-8-25-9-7-22/h2-5,11H,6-10H2,1H3,(H,19,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM50389035
PNG
(CHEMBL2064419)
Show SMILES O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1ccccc1
Show InChI InChI=1S/C16H18N4O3/c21-15(17-12-4-2-1-3-5-12)10-13-18-14(11-16(22)19-13)20-6-8-23-9-7-20/h1-5,11H,6-10H2,(H,17,21)(H,18,19,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of mTOR


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392457
PNG
(CHEMBL2151927)
Show SMILES COc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C17H19FN4O4/c1-25-13-8-11(2-3-12(13)18)19-16(23)9-14-20-15(10-17(24)21-14)22-4-6-26-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)(H,20,21,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392462
PNG
(CHEMBL2151931)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)cc2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H19FN4O3/c1-21-14(10-16(23)19-13-4-2-12(18)3-5-13)20-15(11-17(21)24)22-6-8-25-9-7-22/h2-5,11H,6-10H2,1H3,(H,19,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392460
PNG
(CHEMBL2151929)
Show SMILES [O-][N+](=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C16H16FN5O5/c17-11-2-1-10(7-12(11)22(25)26)18-15(23)8-13-19-14(9-16(24)20-13)21-3-5-27-6-4-21/h1-2,7,9H,3-6,8H2,(H,18,23)(H,19,20,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392453
PNG
(CHEMBL2151923)
Show SMILES Brc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17BrN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392468
PNG
(CHEMBL2151820)
Show SMILES Fc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17FN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392466
PNG
(CHEMBL2151935)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(Cl)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18ClFN4O3/c1-22-14(9-16(24)20-11-2-3-13(19)12(18)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392461
PNG
(CHEMBL2151930)
Show SMILES Cn1c(CC(=O)Nc2ccccc2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H20N4O3/c1-20-14(11-16(22)18-13-5-3-2-4-6-13)19-15(12-17(20)23)21-7-9-24-10-8-21/h2-6,12H,7-11H2,1H3,(H,18,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50392470
PNG
(CHEMBL2151822)
Show SMILES Cc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Show InChI InChI=1S/C17H20N4O3/c1-12-4-2-3-5-13(12)18-16(22)10-14-19-15(11-17(23)20-14)21-6-8-24-9-7-21/h2-5,11H,6-10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392463
PNG
(CHEMBL2151932)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(F)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18F2N4O3/c1-22-14(9-16(24)20-11-2-3-12(18)13(19)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392461
PNG
(CHEMBL2151930)
Show SMILES Cn1c(CC(=O)Nc2ccccc2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H20N4O3/c1-20-14(11-16(22)18-13-5-3-2-4-6-13)19-15(12-17(20)23)21-7-9-24-10-8-21/h2-6,12H,7-11H2,1H3,(H,18,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392451
PNG
(CHEMBL2151921)
Show SMILES Clc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17ClN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50392452
PNG
(CHEMBL2151922)
Show SMILES COc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C17H20N4O4/c1-24-13-4-2-3-12(9-13)18-16(22)10-14-19-15(11-17(23)20-14)21-5-7-25-8-6-21/h2-4,9,11H,5-8,10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (human))
BDBM50392455
PNG
(CHEMBL2151925)
Show SMILES Cc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C17H19FN4O3/c1-11-8-12(2-3-13(11)18)19-16(23)9-14-20-15(10-17(24)21-14)22-4-6-25-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)(H,20,21,24)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CYP3A4


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (human))
BDBM50392456
PNG
(CHEMBL2151926)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Cl
Show InChI InChI=1S/C16H16ClFN4O3/c17-11-7-10(1-2-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CYP3A4


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (human))
BDBM50392469
PNG
(CHEMBL2151821)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Show InChI InChI=1S/C16H17FN4O3/c17-11-1-3-12(4-2-11)18-15(22)9-13-19-14(10-16(23)20-13)21-5-7-24-8-6-21/h1-4,10H,5-9H2,(H,18,22)(H,19,20,23)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CYP3A4


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (human))
BDBM50392451
PNG
(CHEMBL2151921)
Show SMILES Clc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17ClN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CYP3A4


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (human))
BDBM50392457
PNG
(CHEMBL2151927)
Show SMILES COc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Show InChI InChI=1S/C17H19FN4O4/c1-25-13-8-11(2-3-12(13)18)19-16(23)9-14-20-15(10-17(24)21-14)22-4-6-26-7-5-22/h2-3,8,10H,4-7,9H2,1H3,(H,19,23)(H,20,21,24)
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Sanofi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CYP3A4


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (human))
BDBM50392453
PNG
(CHEMBL2151923)
Show SMILES Brc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C16H17BrN4O3/c17-11-2-1-3-12(8-11)18-15(22)9-13-19-14(10-16(23)20-13)21-4-6-24-7-5-21/h1-3,8,10H,4-7,9H2,(H,18,22)(H,19,20,23)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CYP3A4


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (human))
BDBM50392452
PNG
(CHEMBL2151922)
Show SMILES COc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Show InChI InChI=1S/C17H20N4O4/c1-24-13-4-2-3-12(9-13)18-16(22)10-14-19-15(11-17(23)20-14)21-5-7-25-8-6-21/h2-4,9,11H,5-8,10H2,1H3,(H,18,22)(H,19,20,23)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CYP3A4


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (human))
BDBM50389035
PNG
(CHEMBL2064419)
Show SMILES O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1ccccc1
Show InChI InChI=1S/C16H18N4O3/c21-15(17-12-4-2-1-3-5-12)10-13-18-14(11-16(22)19-13)20-6-8-23-9-7-20/h1-5,11H,6-10H2,(H,17,21)(H,18,19,22)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CYP3A4


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (human))
BDBM50392458
PNG
(CHEMBL2151048)
Show SMILES Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Br
Show InChI InChI=1S/C16H16BrFN4O3/c17-11-7-10(1-2-12(11)18)19-15(23)8-13-20-14(9-16(24)21-13)22-3-5-25-6-4-22/h1-2,7,9H,3-6,8H2,(H,19,23)(H,20,21,24)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CYP3A4


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (human))
BDBM50392466
PNG
(CHEMBL2151935)
Show SMILES Cn1c(CC(=O)Nc2ccc(F)c(Cl)c2)nc(cc1=O)N1CCOCC1
Show InChI InChI=1S/C17H18ClFN4O3/c1-22-14(9-16(24)20-11-2-3-13(19)12(18)8-11)21-15(10-17(22)25)23-4-6-26-7-5-23/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Sanofi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CYP3A4


Bioorg Med Chem Lett 22: 6381-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.08.072
BindingDB Entry DOI: 10.7270/Q2FN179H
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%