Found 72 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043008
(CHEMBL3355012)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H18ClN7O/c24-16-8-4-9-17-19(16)23(32)31(14-6-2-1-3-7-14)22(29-17)18-10-5-11-30(18)21-15(12-25)20(26)27-13-28-21/h1-4,6-9,13,18H,5,10-11H2,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043008
(CHEMBL3355012)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H18ClN7O/c24-16-8-4-9-17-19(16)23(32)31(14-6-2-1-3-7-14)22(29-17)18-10-5-11-30(18)21-15(12-25)20(26)27-13-28-21/h1-4,6-9,13,18H,5,10-11H2,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043010
(CHEMBL3355011)Show SMILES Cc1ccccc1-n1c(nc2cccc(Cl)c2c1=O)[C@@H]1CCCN1c1ncnc(N)c1C#N |r,wD:19.21,(7.54,-2.66,;8.88,-3.43,;10.2,-2.66,;11.55,-3.43,;11.54,-4.97,;10.21,-5.74,;8.87,-4.96,;7.54,-5.72,;7.54,-7.28,;6.19,-8.05,;4.85,-7.27,;3.52,-8.04,;2.19,-7.27,;2.19,-5.72,;3.52,-4.95,;3.51,-3.41,;4.85,-5.72,;6.2,-4.94,;6.2,-3.4,;8.87,-8.05,;10.27,-7.42,;11.3,-8.57,;10.52,-9.9,;9.02,-9.58,;7.87,-10.6,;6.41,-10.11,;5.26,-11.14,;5.57,-12.65,;7.04,-13.13,;7.36,-14.64,;8.18,-12.1,;9.65,-12.58,;11.11,-13.05,)| Show InChI InChI=1S/C24H20ClN7O/c1-14-6-2-3-9-18(14)32-23(30-17-8-4-7-16(25)20(17)24(32)33)19-10-5-11-31(19)22-15(12-26)21(27)28-13-29-22/h2-4,6-9,13,19H,5,10-11H2,1H3,(H2,27,28,29)/t19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043010
(CHEMBL3355011)Show SMILES Cc1ccccc1-n1c(nc2cccc(Cl)c2c1=O)[C@@H]1CCCN1c1ncnc(N)c1C#N |r,wD:19.21,(7.54,-2.66,;8.88,-3.43,;10.2,-2.66,;11.55,-3.43,;11.54,-4.97,;10.21,-5.74,;8.87,-4.96,;7.54,-5.72,;7.54,-7.28,;6.19,-8.05,;4.85,-7.27,;3.52,-8.04,;2.19,-7.27,;2.19,-5.72,;3.52,-4.95,;3.51,-3.41,;4.85,-5.72,;6.2,-4.94,;6.2,-3.4,;8.87,-8.05,;10.27,-7.42,;11.3,-8.57,;10.52,-9.9,;9.02,-9.58,;7.87,-10.6,;6.41,-10.11,;5.26,-11.14,;5.57,-12.65,;7.04,-13.13,;7.36,-14.64,;8.18,-12.1,;9.65,-12.58,;11.11,-13.05,)| Show InChI InChI=1S/C24H20ClN7O/c1-14-6-2-3-9-18(14)32-23(30-17-8-4-7-16(25)20(17)24(32)33)19-10-5-11-31(19)22-15(12-26)21(27)28-13-29-22/h2-4,6-9,13,19H,5,10-11H2,1H3,(H2,27,28,29)/t19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043011
(CHEMBL3355022)Show SMILES CO[C@H]1C[C@H](N(C1)c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H20ClN7O2/c1-34-15-10-19(31(12-15)22-16(11-26)21(27)28-13-29-22)23-30-18-9-5-8-17(25)20(18)24(33)32(23)14-6-3-2-4-7-14/h2-9,13,15,19H,10,12H2,1H3,(H2,27,28,29)/t15-,19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043011
(CHEMBL3355022)Show SMILES CO[C@H]1C[C@H](N(C1)c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H20ClN7O2/c1-34-15-10-19(31(12-15)22-16(11-26)21(27)28-13-29-22)23-30-18-9-5-8-17(25)20(18)24(33)32(23)14-6-3-2-4-7-14/h2-9,13,15,19H,10,12H2,1H3,(H2,27,28,29)/t15-,19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043012
(CHEMBL3355021)Show SMILES Nc1ncnc(N2CSC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C22H16ClN7OS/c23-15-7-4-8-16-18(15)22(31)30(13-5-2-1-3-6-13)21(28-16)17-10-32-12-29(17)20-14(9-24)19(25)26-11-27-20/h1-8,11,17H,10,12H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043012
(CHEMBL3355021)Show SMILES Nc1ncnc(N2CSC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C22H16ClN7OS/c23-15-7-4-8-16-18(15)22(31)30(13-5-2-1-3-6-13)21(28-16)17-10-32-12-29(17)20-14(9-24)19(25)26-11-27-20/h1-8,11,17H,10,12H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043001
(CHEMBL3355017)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2C2CCOCC2)c1C#N |r| Show InChI InChI=1S/C22H22ClN7O2/c23-15-3-1-4-16-18(15)22(31)30(13-6-9-32-10-7-13)21(28-16)17-5-2-8-29(17)20-14(11-24)19(25)26-12-27-20/h1,3-4,12-13,17H,2,5-10H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043001
(CHEMBL3355017)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2C2CCOCC2)c1C#N |r| Show InChI InChI=1S/C22H22ClN7O2/c23-15-3-1-4-16-18(15)22(31)30(13-6-9-32-10-7-13)21(28-16)17-5-2-8-29(17)20-14(11-24)19(25)26-12-27-20/h1,3-4,12-13,17H,2,5-10H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043003
(CHEMBL3355016)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2N2CCOCC2)c1C#N |r| Show InChI InChI=1S/C21H21ClN8O2/c22-14-3-1-4-15-17(14)21(31)30(28-7-9-32-10-8-28)20(27-15)16-5-2-6-29(16)19-13(11-23)18(24)25-12-26-19/h1,3-4,12,16H,2,5-10H2,(H2,24,25,26)/t16-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043003
(CHEMBL3355016)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2N2CCOCC2)c1C#N |r| Show InChI InChI=1S/C21H21ClN8O2/c22-14-3-1-4-15-17(14)21(31)30(28-7-9-32-10-8-28)20(27-15)16-5-2-6-29(16)19-13(11-23)18(24)25-12-26-19/h1,3-4,12,16H,2,5-10H2,(H2,24,25,26)/t16-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043000
(CHEMBL3355018)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(c3c(=O)n2-c2ccccc2)C(F)(F)F)c1C#N |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)23(35)34(14-6-2-1-3-7-14)22(32-17)18-10-5-11-33(18)21-15(12-28)20(29)30-13-31-21/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,31)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043000
(CHEMBL3355018)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(c3c(=O)n2-c2ccccc2)C(F)(F)F)c1C#N |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)23(35)34(14-6-2-1-3-7-14)22(32-17)18-10-5-11-33(18)21-15(12-28)20(29)30-13-31-21/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,31)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043002
(CHEMBL3355015)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2cccnc2)c1C#N |r| Show InChI InChI=1S/C22H17ClN8O/c23-15-5-1-6-16-18(15)22(32)31(13-4-2-8-26-11-13)21(29-16)17-7-3-9-30(17)20-14(10-24)19(25)27-12-28-20/h1-2,4-6,8,11-12,17H,3,7,9H2,(H2,25,27,28)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043002
(CHEMBL3355015)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2cccnc2)c1C#N |r| Show InChI InChI=1S/C22H17ClN8O/c23-15-5-1-6-16-18(15)22(32)31(13-4-2-8-26-11-13)21(29-16)17-7-3-9-30(17)20-14(10-24)19(25)27-12-28-20/h1-2,4-6,8,11-12,17H,3,7,9H2,(H2,25,27,28)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043004
(CHEMBL3355020)Show SMILES Nc1ncc(C#N)c(n1)N1CCC[C@H]1c1nc2cccc(c2c(=O)n1-c1ccccc1)C(F)(F)F |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)22(35)34(15-6-2-1-3-7-15)21(31-17)18-10-5-11-33(18)20-14(12-28)13-30-23(29)32-20/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,32)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043004
(CHEMBL3355020)Show SMILES Nc1ncc(C#N)c(n1)N1CCC[C@H]1c1nc2cccc(c2c(=O)n1-c1ccccc1)C(F)(F)F |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)22(35)34(15-6-2-1-3-7-15)21(31-17)18-10-5-11-33(18)20-14(12-28)13-30-23(29)32-20/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,32)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043008
(CHEMBL3355012)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H18ClN7O/c24-16-8-4-9-17-19(16)23(32)31(14-6-2-1-3-7-14)22(29-17)18-10-5-11-30(18)21-15(12-25)20(26)27-13-28-21/h1-4,6-9,13,18H,5,10-11H2,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043008
(CHEMBL3355012)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H18ClN7O/c24-16-8-4-9-17-19(16)23(32)31(14-6-2-1-3-7-14)22(29-17)18-10-5-11-30(18)21-15(12-25)20(26)27-13-28-21/h1-4,6-9,13,18H,5,10-11H2,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043011
(CHEMBL3355022)Show SMILES CO[C@H]1C[C@H](N(C1)c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H20ClN7O2/c1-34-15-10-19(31(12-15)22-16(11-26)21(27)28-13-29-22)23-30-18-9-5-8-17(25)20(18)24(33)32(23)14-6-3-2-4-7-14/h2-9,13,15,19H,10,12H2,1H3,(H2,27,28,29)/t15-,19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043011
(CHEMBL3355022)Show SMILES CO[C@H]1C[C@H](N(C1)c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H20ClN7O2/c1-34-15-10-19(31(12-15)22-16(11-26)21(27)28-13-29-22)23-30-18-9-5-8-17(25)20(18)24(33)32(23)14-6-3-2-4-7-14/h2-9,13,15,19H,10,12H2,1H3,(H2,27,28,29)/t15-,19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043005
(CHEMBL3355019)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cc(F)cc(F)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H17F2N7O/c24-13-9-16(25)19-17(10-13)30-22(32(23(19)33)14-5-2-1-3-6-14)18-7-4-8-31(18)21-15(11-26)20(27)28-12-29-21/h1-3,5-6,9-10,12,18H,4,7-8H2,(H2,27,28,29)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043005
(CHEMBL3355019)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cc(F)cc(F)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H17F2N7O/c24-13-9-16(25)19-17(10-13)30-22(32(23(19)33)14-5-2-1-3-6-14)18-7-4-8-31(18)21-15(11-26)20(27)28-12-29-21/h1-3,5-6,9-10,12,18H,4,7-8H2,(H2,27,28,29)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043007
(CHEMBL3355013)Show SMILES Cn1cnc2c(nc(N)nc12)N1CCC[C@H]1c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H21ClN8O/c1-31-13-27-19-21(31)29-24(26)30-22(19)32-12-6-11-17(32)20-28-16-10-5-9-15(25)18(16)23(34)33(20)14-7-3-2-4-8-14/h2-5,7-10,13,17H,6,11-12H2,1H3,(H2,26,29,30)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043007
(CHEMBL3355013)Show SMILES Cn1cnc2c(nc(N)nc12)N1CCC[C@H]1c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H21ClN8O/c1-31-13-27-19-21(31)29-24(26)30-22(19)32-12-6-11-17(32)20-28-16-10-5-9-15(25)18(16)23(34)33(20)14-7-3-2-4-8-14/h2-5,7-10,13,17H,6,11-12H2,1H3,(H2,26,29,30)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043010
(CHEMBL3355011)Show SMILES Cc1ccccc1-n1c(nc2cccc(Cl)c2c1=O)[C@@H]1CCCN1c1ncnc(N)c1C#N |r,wD:19.21,(7.54,-2.66,;8.88,-3.43,;10.2,-2.66,;11.55,-3.43,;11.54,-4.97,;10.21,-5.74,;8.87,-4.96,;7.54,-5.72,;7.54,-7.28,;6.19,-8.05,;4.85,-7.27,;3.52,-8.04,;2.19,-7.27,;2.19,-5.72,;3.52,-4.95,;3.51,-3.41,;4.85,-5.72,;6.2,-4.94,;6.2,-3.4,;8.87,-8.05,;10.27,-7.42,;11.3,-8.57,;10.52,-9.9,;9.02,-9.58,;7.87,-10.6,;6.41,-10.11,;5.26,-11.14,;5.57,-12.65,;7.04,-13.13,;7.36,-14.64,;8.18,-12.1,;9.65,-12.58,;11.11,-13.05,)| Show InChI InChI=1S/C24H20ClN7O/c1-14-6-2-3-9-18(14)32-23(30-17-8-4-7-16(25)20(17)24(32)33)19-10-5-11-31(19)22-15(12-26)21(27)28-13-29-22/h2-4,6-9,13,19H,5,10-11H2,1H3,(H2,27,28,29)/t19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043010
(CHEMBL3355011)Show SMILES Cc1ccccc1-n1c(nc2cccc(Cl)c2c1=O)[C@@H]1CCCN1c1ncnc(N)c1C#N |r,wD:19.21,(7.54,-2.66,;8.88,-3.43,;10.2,-2.66,;11.55,-3.43,;11.54,-4.97,;10.21,-5.74,;8.87,-4.96,;7.54,-5.72,;7.54,-7.28,;6.19,-8.05,;4.85,-7.27,;3.52,-8.04,;2.19,-7.27,;2.19,-5.72,;3.52,-4.95,;3.51,-3.41,;4.85,-5.72,;6.2,-4.94,;6.2,-3.4,;8.87,-8.05,;10.27,-7.42,;11.3,-8.57,;10.52,-9.9,;9.02,-9.58,;7.87,-10.6,;6.41,-10.11,;5.26,-11.14,;5.57,-12.65,;7.04,-13.13,;7.36,-14.64,;8.18,-12.1,;9.65,-12.58,;11.11,-13.05,)| Show InChI InChI=1S/C24H20ClN7O/c1-14-6-2-3-9-18(14)32-23(30-17-8-4-7-16(25)20(17)24(32)33)19-10-5-11-31(19)22-15(12-26)21(27)28-13-29-22/h2-4,6-9,13,19H,5,10-11H2,1H3,(H2,27,28,29)/t19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043006
(CHEMBL3355014)Show SMILES COc1cccc2nc([C@@H]3CCCN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r| Show InChI InChI=1S/C24H21N7O2/c1-33-19-11-5-9-17-20(19)24(32)31(15-7-3-2-4-8-15)23(29-17)18-10-6-12-30(18)22-16(13-25)21(26)27-14-28-22/h2-5,7-9,11,14,18H,6,10,12H2,1H3,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 76 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50043006
(CHEMBL3355014)Show SMILES COc1cccc2nc([C@@H]3CCCN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r| Show InChI InChI=1S/C24H21N7O2/c1-33-19-11-5-9-17-20(19)24(32)31(15-7-3-2-4-8-15)23(29-17)18-10-6-12-30(18)22-16(13-25)21(26)27-14-28-22/h2-5,7-9,11,14,18H,6,10,12H2,1H3,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 76 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kdelta (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043012
(CHEMBL3355021)Show SMILES Nc1ncnc(N2CSC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C22H16ClN7OS/c23-15-7-4-8-16-18(15)22(31)30(13-5-2-1-3-6-13)21(28-16)17-10-32-12-29(17)20-14(9-24)19(25)26-11-27-20/h1-8,11,17H,10,12H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 129 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043012
(CHEMBL3355021)Show SMILES Nc1ncnc(N2CSC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C22H16ClN7OS/c23-15-7-4-8-16-18(15)22(31)30(13-5-2-1-3-6-13)21(28-16)17-10-32-12-29(17)20-14(9-24)19(25)26-11-27-20/h1-8,11,17H,10,12H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 129 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043000
(CHEMBL3355018)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(c3c(=O)n2-c2ccccc2)C(F)(F)F)c1C#N |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)23(35)34(14-6-2-1-3-7-14)22(32-17)18-10-5-11-33(18)21-15(12-28)20(29)30-13-31-21/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,31)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043000
(CHEMBL3355018)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(c3c(=O)n2-c2ccccc2)C(F)(F)F)c1C#N |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)23(35)34(14-6-2-1-3-7-14)22(32-17)18-10-5-11-33(18)21-15(12-28)20(29)30-13-31-21/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,31)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043002
(CHEMBL3355015)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2cccnc2)c1C#N |r| Show InChI InChI=1S/C22H17ClN8O/c23-15-5-1-6-16-18(15)22(32)31(13-4-2-8-26-11-13)21(29-16)17-7-3-9-30(17)20-14(10-24)19(25)27-12-28-20/h1-2,4-6,8,11-12,17H,3,7,9H2,(H2,25,27,28)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043002
(CHEMBL3355015)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2cccnc2)c1C#N |r| Show InChI InChI=1S/C22H17ClN8O/c23-15-5-1-6-16-18(15)22(32)31(13-4-2-8-26-11-13)21(29-16)17-7-3-9-30(17)20-14(10-24)19(25)27-12-28-20/h1-2,4-6,8,11-12,17H,3,7,9H2,(H2,25,27,28)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043003
(CHEMBL3355016)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2N2CCOCC2)c1C#N |r| Show InChI InChI=1S/C21H21ClN8O2/c22-14-3-1-4-15-17(14)21(31)30(28-7-9-32-10-8-28)20(27-15)16-5-2-6-29(16)19-13(11-23)18(24)25-12-26-19/h1,3-4,12,16H,2,5-10H2,(H2,24,25,26)/t16-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043003
(CHEMBL3355016)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2N2CCOCC2)c1C#N |r| Show InChI InChI=1S/C21H21ClN8O2/c22-14-3-1-4-15-17(14)21(31)30(28-7-9-32-10-8-28)20(27-15)16-5-2-6-29(16)19-13(11-23)18(24)25-12-26-19/h1,3-4,12,16H,2,5-10H2,(H2,24,25,26)/t16-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043004
(CHEMBL3355020)Show SMILES Nc1ncc(C#N)c(n1)N1CCC[C@H]1c1nc2cccc(c2c(=O)n1-c1ccccc1)C(F)(F)F |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)22(35)34(15-6-2-1-3-7-15)21(31-17)18-10-5-11-33(18)20-14(12-28)13-30-23(29)32-20/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,32)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043004
(CHEMBL3355020)Show SMILES Nc1ncc(C#N)c(n1)N1CCC[C@H]1c1nc2cccc(c2c(=O)n1-c1ccccc1)C(F)(F)F |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)22(35)34(15-6-2-1-3-7-15)21(31-17)18-10-5-11-33(18)20-14(12-28)13-30-23(29)32-20/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,32)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043001
(CHEMBL3355017)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2C2CCOCC2)c1C#N |r| Show InChI InChI=1S/C22H22ClN7O2/c23-15-3-1-4-16-18(15)22(31)30(13-6-9-32-10-7-13)21(28-16)17-5-2-8-29(17)20-14(11-24)19(25)26-12-27-20/h1,3-4,12-13,17H,2,5-10H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043001
(CHEMBL3355017)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2C2CCOCC2)c1C#N |r| Show InChI InChI=1S/C22H22ClN7O2/c23-15-3-1-4-16-18(15)22(31)30(13-6-9-32-10-7-13)21(28-16)17-5-2-8-29(17)20-14(11-24)19(25)26-12-27-20/h1,3-4,12-13,17H,2,5-10H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043007
(CHEMBL3355013)Show SMILES Cn1cnc2c(nc(N)nc12)N1CCC[C@H]1c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H21ClN8O/c1-31-13-27-19-21(31)29-24(26)30-22(19)32-12-6-11-17(32)20-28-16-10-5-9-15(25)18(16)23(34)33(20)14-7-3-2-4-8-14/h2-5,7-10,13,17H,6,11-12H2,1H3,(H2,26,29,30)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 305 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043007
(CHEMBL3355013)Show SMILES Cn1cnc2c(nc(N)nc12)N1CCC[C@H]1c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H21ClN8O/c1-31-13-27-19-21(31)29-24(26)30-22(19)32-12-6-11-17(32)20-28-16-10-5-9-15(25)18(16)23(34)33(20)14-7-3-2-4-8-14/h2-5,7-10,13,17H,6,11-12H2,1H3,(H2,26,29,30)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 305 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043008
(CHEMBL3355012)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H18ClN7O/c24-16-8-4-9-17-19(16)23(32)31(14-6-2-1-3-7-14)22(29-17)18-10-5-11-30(18)21-15(12-25)20(26)27-13-28-21/h1-4,6-9,13,18H,5,10-11H2,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 393 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043008
(CHEMBL3355012)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H18ClN7O/c24-16-8-4-9-17-19(16)23(32)31(14-6-2-1-3-7-14)22(29-17)18-10-5-11-30(18)21-15(12-25)20(26)27-13-28-21/h1-4,6-9,13,18H,5,10-11H2,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 393 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043011
(CHEMBL3355022)Show SMILES CO[C@H]1C[C@H](N(C1)c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H20ClN7O2/c1-34-15-10-19(31(12-15)22-16(11-26)21(27)28-13-29-22)23-30-18-9-5-8-17(25)20(18)24(33)32(23)14-6-3-2-4-7-14/h2-9,13,15,19H,10,12H2,1H3,(H2,27,28,29)/t15-,19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043011
(CHEMBL3355022)Show SMILES CO[C@H]1C[C@H](N(C1)c1ncnc(N)c1C#N)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H20ClN7O2/c1-34-15-10-19(31(12-15)22-16(11-26)21(27)28-13-29-22)23-30-18-9-5-8-17(25)20(18)24(33)32(23)14-6-3-2-4-7-14/h2-9,13,15,19H,10,12H2,1H3,(H2,27,28,29)/t15-,19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043003
(CHEMBL3355016)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2N2CCOCC2)c1C#N |r| Show InChI InChI=1S/C21H21ClN8O2/c22-14-3-1-4-15-17(14)21(31)30(28-7-9-32-10-8-28)20(27-15)16-5-2-6-29(16)19-13(11-23)18(24)25-12-26-19/h1,3-4,12,16H,2,5-10H2,(H2,24,25,26)/t16-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043003
(CHEMBL3355016)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2N2CCOCC2)c1C#N |r| Show InChI InChI=1S/C21H21ClN8O2/c22-14-3-1-4-15-17(14)21(31)30(28-7-9-32-10-8-28)20(27-15)16-5-2-6-29(16)19-13(11-23)18(24)25-12-26-19/h1,3-4,12,16H,2,5-10H2,(H2,24,25,26)/t16-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043012
(CHEMBL3355021)Show SMILES Nc1ncnc(N2CSC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C22H16ClN7OS/c23-15-7-4-8-16-18(15)22(31)30(13-5-2-1-3-6-13)21(28-16)17-10-32-12-29(17)20-14(9-24)19(25)26-11-27-20/h1-8,11,17H,10,12H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043012
(CHEMBL3355021)Show SMILES Nc1ncnc(N2CSC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C22H16ClN7OS/c23-15-7-4-8-16-18(15)22(31)30(13-5-2-1-3-6-13)21(28-16)17-10-32-12-29(17)20-14(9-24)19(25)26-11-27-20/h1-8,11,17H,10,12H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043000
(CHEMBL3355018)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(c3c(=O)n2-c2ccccc2)C(F)(F)F)c1C#N |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)23(35)34(14-6-2-1-3-7-14)22(32-17)18-10-5-11-33(18)21-15(12-28)20(29)30-13-31-21/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,31)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043000
(CHEMBL3355018)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(c3c(=O)n2-c2ccccc2)C(F)(F)F)c1C#N |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)23(35)34(14-6-2-1-3-7-14)22(32-17)18-10-5-11-33(18)21-15(12-28)20(29)30-13-31-21/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,31)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043004
(CHEMBL3355020)Show SMILES Nc1ncc(C#N)c(n1)N1CCC[C@H]1c1nc2cccc(c2c(=O)n1-c1ccccc1)C(F)(F)F |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)22(35)34(15-6-2-1-3-7-15)21(31-17)18-10-5-11-33(18)20-14(12-28)13-30-23(29)32-20/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,32)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043004
(CHEMBL3355020)Show SMILES Nc1ncc(C#N)c(n1)N1CCC[C@H]1c1nc2cccc(c2c(=O)n1-c1ccccc1)C(F)(F)F |r| Show InChI InChI=1S/C24H18F3N7O/c25-24(26,27)16-8-4-9-17-19(16)22(35)34(15-6-2-1-3-7-15)21(31-17)18-10-5-11-33(18)20-14(12-28)13-30-23(29)32-20/h1-4,6-9,13,18H,5,10-11H2,(H2,29,30,32)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043007
(CHEMBL3355013)Show SMILES Cn1cnc2c(nc(N)nc12)N1CCC[C@H]1c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H21ClN8O/c1-31-13-27-19-21(31)29-24(26)30-22(19)32-12-6-11-17(32)20-28-16-10-5-9-15(25)18(16)23(34)33(20)14-7-3-2-4-8-14/h2-5,7-10,13,17H,6,11-12H2,1H3,(H2,26,29,30)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043007
(CHEMBL3355013)Show SMILES Cn1cnc2c(nc(N)nc12)N1CCC[C@H]1c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 |r| Show InChI InChI=1S/C24H21ClN8O/c1-31-13-27-19-21(31)29-24(26)30-22(19)32-12-6-11-17(32)20-28-16-10-5-9-15(25)18(16)23(34)33(20)14-7-3-2-4-8-14/h2-5,7-10,13,17H,6,11-12H2,1H3,(H2,26,29,30)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043001
(CHEMBL3355017)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2C2CCOCC2)c1C#N |r| Show InChI InChI=1S/C22H22ClN7O2/c23-15-3-1-4-16-18(15)22(31)30(13-6-9-32-10-7-13)21(28-16)17-5-2-8-29(17)20-14(11-24)19(25)26-12-27-20/h1,3-4,12-13,17H,2,5-10H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 4.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043001
(CHEMBL3355017)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2C2CCOCC2)c1C#N |r| Show InChI InChI=1S/C22H22ClN7O2/c23-15-3-1-4-16-18(15)22(31)30(13-6-9-32-10-7-13)21(28-16)17-5-2-8-29(17)20-14(11-24)19(25)26-12-27-20/h1,3-4,12-13,17H,2,5-10H2,(H2,25,26,27)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 4.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043006
(CHEMBL3355014)Show SMILES COc1cccc2nc([C@@H]3CCCN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r| Show InChI InChI=1S/C24H21N7O2/c1-33-19-11-5-9-17-20(19)24(32)31(15-7-3-2-4-8-15)23(29-17)18-10-6-12-30(18)22-16(13-25)21(26)27-14-28-22/h2-5,7-9,11,14,18H,6,10,12H2,1H3,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043006
(CHEMBL3355014)Show SMILES COc1cccc2nc([C@@H]3CCCN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r| Show InChI InChI=1S/C24H21N7O2/c1-33-19-11-5-9-17-20(19)24(32)31(15-7-3-2-4-8-15)23(29-17)18-10-6-12-30(18)22-16(13-25)21(26)27-14-28-22/h2-5,7-9,11,14,18H,6,10,12H2,1H3,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043010
(CHEMBL3355011)Show SMILES Cc1ccccc1-n1c(nc2cccc(Cl)c2c1=O)[C@@H]1CCCN1c1ncnc(N)c1C#N |r,wD:19.21,(7.54,-2.66,;8.88,-3.43,;10.2,-2.66,;11.55,-3.43,;11.54,-4.97,;10.21,-5.74,;8.87,-4.96,;7.54,-5.72,;7.54,-7.28,;6.19,-8.05,;4.85,-7.27,;3.52,-8.04,;2.19,-7.27,;2.19,-5.72,;3.52,-4.95,;3.51,-3.41,;4.85,-5.72,;6.2,-4.94,;6.2,-3.4,;8.87,-8.05,;10.27,-7.42,;11.3,-8.57,;10.52,-9.9,;9.02,-9.58,;7.87,-10.6,;6.41,-10.11,;5.26,-11.14,;5.57,-12.65,;7.04,-13.13,;7.36,-14.64,;8.18,-12.1,;9.65,-12.58,;11.11,-13.05,)| Show InChI InChI=1S/C24H20ClN7O/c1-14-6-2-3-9-18(14)32-23(30-17-8-4-7-16(25)20(17)24(32)33)19-10-5-11-31(19)22-15(12-26)21(27)28-13-29-22/h2-4,6-9,13,19H,5,10-11H2,1H3,(H2,27,28,29)/t19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.21E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043010
(CHEMBL3355011)Show SMILES Cc1ccccc1-n1c(nc2cccc(Cl)c2c1=O)[C@@H]1CCCN1c1ncnc(N)c1C#N |r,wD:19.21,(7.54,-2.66,;8.88,-3.43,;10.2,-2.66,;11.55,-3.43,;11.54,-4.97,;10.21,-5.74,;8.87,-4.96,;7.54,-5.72,;7.54,-7.28,;6.19,-8.05,;4.85,-7.27,;3.52,-8.04,;2.19,-7.27,;2.19,-5.72,;3.52,-4.95,;3.51,-3.41,;4.85,-5.72,;6.2,-4.94,;6.2,-3.4,;8.87,-8.05,;10.27,-7.42,;11.3,-8.57,;10.52,-9.9,;9.02,-9.58,;7.87,-10.6,;6.41,-10.11,;5.26,-11.14,;5.57,-12.65,;7.04,-13.13,;7.36,-14.64,;8.18,-12.1,;9.65,-12.58,;11.11,-13.05,)| Show InChI InChI=1S/C24H20ClN7O/c1-14-6-2-3-9-18(14)32-23(30-17-8-4-7-16(25)20(17)24(32)33)19-10-5-11-31(19)22-15(12-26)21(27)28-13-29-22/h2-4,6-9,13,19H,5,10-11H2,1H3,(H2,27,28,29)/t19-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.21E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043002
(CHEMBL3355015)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2cccnc2)c1C#N |r| Show InChI InChI=1S/C22H17ClN8O/c23-15-5-1-6-16-18(15)22(32)31(13-4-2-8-26-11-13)21(29-16)17-7-3-9-30(17)20-14(10-24)19(25)27-12-28-20/h1-2,4-6,8,11-12,17H,3,7,9H2,(H2,25,27,28)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 7.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043002
(CHEMBL3355015)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cccc(Cl)c3c(=O)n2-c2cccnc2)c1C#N |r| Show InChI InChI=1S/C22H17ClN8O/c23-15-5-1-6-16-18(15)22(32)31(13-4-2-8-26-11-13)21(29-16)17-7-3-9-30(17)20-14(10-24)19(25)27-12-28-20/h1-2,4-6,8,11-12,17H,3,7,9H2,(H2,25,27,28)/t17-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 7.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043005
(CHEMBL3355019)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cc(F)cc(F)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H17F2N7O/c24-13-9-16(25)19-17(10-13)30-22(32(23(19)33)14-5-2-1-3-6-14)18-7-4-8-31(18)21-15(11-26)20(27)28-12-29-21/h1-3,5-6,9-10,12,18H,4,7-8H2,(H2,27,28,29)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50043005
(CHEMBL3355019)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cc(F)cc(F)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H17F2N7O/c24-13-9-16(25)19-17(10-13)30-22(32(23(19)33)14-5-2-1-3-6-14)18-7-4-8-31(18)21-15(11-26)20(27)28-12-29-21/h1-3,5-6,9-10,12,18H,4,7-8H2,(H2,27,28,29)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kgamma (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043005
(CHEMBL3355019)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cc(F)cc(F)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H17F2N7O/c24-13-9-16(25)19-17(10-13)30-22(32(23(19)33)14-5-2-1-3-6-14)18-7-4-8-31(18)21-15(11-26)20(27)28-12-29-21/h1-3,5-6,9-10,12,18H,4,7-8H2,(H2,27,28,29)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043006
(CHEMBL3355014)Show SMILES COc1cccc2nc([C@@H]3CCCN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r| Show InChI InChI=1S/C24H21N7O2/c1-33-19-11-5-9-17-20(19)24(32)31(15-7-3-2-4-8-15)23(29-17)18-10-6-12-30(18)22-16(13-25)21(26)27-14-28-22/h2-5,7-9,11,14,18H,6,10,12H2,1H3,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043006
(CHEMBL3355014)Show SMILES COc1cccc2nc([C@@H]3CCCN3c3ncnc(N)c3C#N)n(-c3ccccc3)c(=O)c12 |r| Show InChI InChI=1S/C24H21N7O2/c1-33-19-11-5-9-17-20(19)24(32)31(15-7-3-2-4-8-15)23(29-17)18-10-6-12-30(18)22-16(13-25)21(26)27-14-28-22/h2-5,7-9,11,14,18H,6,10,12H2,1H3,(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) by TR-FRET assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50043005
(CHEMBL3355019)Show SMILES Nc1ncnc(N2CCC[C@H]2c2nc3cc(F)cc(F)c3c(=O)n2-c2ccccc2)c1C#N |r| Show InChI InChI=1S/C23H17F2N7O/c24-13-9-16(25)19-17(10-13)30-22(32(23(19)33)14-5-2-1-3-6-14)18-7-4-8-31(18)21-15(11-26)20(27)28-12-29-21/h1-3,5-6,9-10,12,18H,4,7-8H2,(H2,27,28,29)/t18-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Dart Neuroscience LLC
Curated by ChEMBL
| Assay Description
Inhibition of PI3Kalpha (unknown origin) assessed as PI3Kalpha-mediated Akt1/2 (S473) phosphorylation rate by cellular assay |
ACS Med Chem Lett 6: 15-6 (2015)
Article DOI: 10.1021/ml500435u
BindingDB Entry DOI: 10.7270/Q2ZG6TW0 |
More data for this
Ligand-Target Pair | |
Search and Browse
