Found 24 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 |
|---|
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50372472
(CHEMBL255592)Show SMILES Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)C#Cc1cccnc1 Show InChI InChI=1S/C28H21N5O/c1-28(2,18-29)21-9-11-22(12-10-21)33-26-23-15-19(6-7-20-5-4-14-30-16-20)8-13-24(23)31-17-25(26)32(3)27(33)34/h4-5,8-17H,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of phosphorylation of T308-PKB in human U87MG cells by ELISA |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
3-phosphoinositide-dependent protein kinase 1
(Homo sapiens (Human)) | BDBM50372471
(CHEMBL272265)Show SMILES N#CCc1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1 Show InChI InChI=1S/C25H15N5/c26-12-11-18-5-8-21(9-6-18)30-17-29-24-16-28-23-10-7-19(14-22(23)25(24)30)3-4-20-2-1-13-27-15-20/h1-2,5-10,13-17H,11H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PDK1 |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50372473
(CHEMBL270638)Show SMILES CC(C#N)c1ccc(cc1)-n1c(C)nc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0| Show InChI InChI=1S/C27H19N5/c1-18(15-28)22-8-10-23(11-9-22)32-19(2)31-26-17-30-25-12-7-20(14-24(25)27(26)32)5-6-21-4-3-13-29-16-21/h3-4,7-14,16-18H,1-2H3 | 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 | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110delta |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50372473
(CHEMBL270638)Show SMILES CC(C#N)c1ccc(cc1)-n1c(C)nc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0| Show InChI InChI=1S/C27H19N5/c1-18(15-28)22-8-10-23(11-9-22)32-19(2)31-26-17-30-25-12-7-20(14-24(25)27(26)32)5-6-21-4-3-13-29-16-21/h3-4,7-14,16-18H,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of phosphorylation of T308-PKB in human U87MG cells by ELISA |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50372473
(CHEMBL270638)Show SMILES CC(C#N)c1ccc(cc1)-n1c(C)nc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0| Show InChI InChI=1S/C27H19N5/c1-18(15-28)22-8-10-23(11-9-22)32-19(2)31-26-17-30-25-12-7-20(14-24(25)27(26)32)5-6-21-4-3-13-29-16-21/h3-4,7-14,16-18H,1-2H3 | 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 | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110alpha |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50372471
(CHEMBL272265)Show SMILES N#CCc1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1 Show InChI InChI=1S/C25H15N5/c26-12-11-18-5-8-21(9-6-18)30-17-29-24-16-28-23-10-7-19(14-22(23)25(24)30)3-4-20-2-1-13-27-15-20/h1-2,5-10,13-17H,11H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 64 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110alpha |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50372471
(CHEMBL272265)Show SMILES N#CCc1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1 Show InChI InChI=1S/C25H15N5/c26-12-11-18-5-8-21(9-6-18)30-17-29-24-16-28-23-10-7-19(14-22(23)25(24)30)3-4-20-2-1-13-27-15-20/h1-2,5-10,13-17H,11H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110gamma |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human)) | BDBM50372472
(CHEMBL255592)Show SMILES Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)C#Cc1cccnc1 Show InChI InChI=1S/C28H21N5O/c1-28(2,18-29)21-9-11-22(12-10-21)33-26-23-15-19(6-7-20-5-4-14-30-16-20)8-13-24(23)31-17-25(26)32(3)27(33)34/h4-5,8-17H,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 72 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110alpha |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50372475
(CHEMBL270639)Show SMILES Cc1nc2cnc3ccc(cc3c2n1-c1ccc(CC#N)cc1)C#Cc1cccnc1 Show InChI InChI=1S/C26H17N5/c1-18-30-25-17-29-24-11-8-20(4-5-21-3-2-14-28-16-21)15-23(24)26(25)31(18)22-9-6-19(7-10-22)12-13-27/h2-3,6-11,14-17H,12H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 77 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of phosphorylation of T308-PKB in human U87MG cells by ELISA |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50372471
(CHEMBL272265)Show SMILES N#CCc1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1 Show InChI InChI=1S/C25H15N5/c26-12-11-18-5-8-21(9-6-18)30-17-29-24-16-28-23-10-7-19(14-22(23)25(24)30)3-4-20-2-1-13-27-15-20/h1-2,5-10,13-17H,11H2 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 94 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of phosphorylation of T308-PKB in human U87MG cells by ELISA |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50372471
(CHEMBL272265)Show SMILES N#CCc1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1 Show InChI InChI=1S/C25H15N5/c26-12-11-18-5-8-21(9-6-18)30-17-29-24-16-28-23-10-7-19(14-22(23)25(24)30)3-4-20-2-1-13-27-15-20/h1-2,5-10,13-17H,11H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 98 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110delta |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
3-phosphoinositide-dependent protein kinase 1
(Homo sapiens (Human)) | BDBM50372475
(CHEMBL270639)Show SMILES Cc1nc2cnc3ccc(cc3c2n1-c1ccc(CC#N)cc1)C#Cc1cccnc1 Show InChI InChI=1S/C26H17N5/c1-18-30-25-17-29-24-11-8-20(4-5-21-3-2-14-28-16-21)15-23(24)26(25)31(18)22-9-6-19(7-10-22)12-13-27/h2-3,6-11,14-17H,12H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PDK1 |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50372473
(CHEMBL270638)Show SMILES CC(C#N)c1ccc(cc1)-n1c(C)nc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0| Show InChI InChI=1S/C27H19N5/c1-18(15-28)22-8-10-23(11-9-22)32-19(2)31-26-17-30-25-12-7-20(14-24(25)27(26)32)5-6-21-4-3-13-29-16-21/h3-4,7-14,16-18H,1-2H3 | 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 | 117 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110gamma |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50372476
(CHEMBL270640)Show SMILES CCc1nc2cnc3ccc(cc3c2n1-c1ccc(CC#N)cc1)C#Cc1cccnc1 Show InChI InChI=1S/C27H19N5/c1-2-26-31-25-18-30-24-12-9-20(5-6-21-4-3-15-29-17-21)16-23(24)27(25)32(26)22-10-7-19(8-11-22)13-14-28/h3-4,7-12,15-18H,2,13H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 138 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of phosphorylation of T308-PKB in human U87MG cells by ELISA |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50372474
(CHEMBL404024)Show SMILES CC(C#N)c1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0| Show InChI InChI=1S/C26H17N5/c1-18(14-27)21-7-9-22(10-8-21)31-17-30-25-16-29-24-11-6-19(13-23(24)26(25)31)4-5-20-3-2-12-28-15-20/h2-3,6-13,15-18H,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 139 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of phosphorylation of T308-PKB in human U87MG cells by ELISA |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
3-phosphoinositide-dependent protein kinase 1
(Homo sapiens (Human)) | BDBM50372474
(CHEMBL404024)Show SMILES CC(C#N)c1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0| Show InChI InChI=1S/C26H17N5/c1-18(14-27)21-7-9-22(10-8-21)31-17-30-25-16-29-24-11-6-19(13-23(24)26(25)31)4-5-20-3-2-12-28-15-20/h2-3,6-13,15-18H,1H3 | 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 | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PDK1 |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human)) | BDBM50372472
(CHEMBL255592)Show SMILES Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)C#Cc1cccnc1 Show InChI InChI=1S/C28H21N5O/c1-28(2,18-29)21-9-11-22(12-10-21)33-26-23-15-19(6-7-20-5-4-14-30-16-20)8-13-24(23)31-17-25(26)32(3)27(33)34/h4-5,8-17H,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 201 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110delta |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
3-phosphoinositide-dependent protein kinase 1
(Homo sapiens (Human)) | BDBM50372473
(CHEMBL270638)Show SMILES CC(C#N)c1ccc(cc1)-n1c(C)nc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0| Show InChI InChI=1S/C27H19N5/c1-18(15-28)22-8-10-23(11-9-22)32-19(2)31-26-17-30-25-12-7-20(14-24(25)27(26)32)5-6-21-4-3-13-29-16-21/h3-4,7-14,16-18H,1-2H3 | 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 | 245 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PDK1 |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
3-phosphoinositide-dependent protein kinase 1
(Homo sapiens (Human)) | BDBM50372476
(CHEMBL270640)Show SMILES CCc1nc2cnc3ccc(cc3c2n1-c1ccc(CC#N)cc1)C#Cc1cccnc1 Show InChI InChI=1S/C27H19N5/c1-2-26-31-25-18-30-24-12-9-20(5-6-21-4-3-15-29-17-21)16-23(24)27(25)32(26)22-10-7-19(8-11-22)13-14-28/h3-4,7-12,15-18H,2,13H2,1H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 327 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PDK1 |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human)) | BDBM50372472
(CHEMBL255592)Show SMILES Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)C#Cc1cccnc1 Show InChI InChI=1S/C28H21N5O/c1-28(2,18-29)21-9-11-22(12-10-21)33-26-23-15-19(6-7-20-5-4-14-30-16-20)8-13-24(23)31-17-25(26)32(3)27(33)34/h4-5,8-17H,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 382 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110gamma |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
(Homo sapiens (Human)) | BDBM50372471
(CHEMBL272265)Show SMILES N#CCc1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1 Show InChI InChI=1S/C25H15N5/c26-12-11-18-5-8-21(9-6-18)30-17-29-24-16-28-23-10-7-19(14-22(23)25(24)30)3-4-20-2-1-13-27-15-20/h1-2,5-10,13-17H,11H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 432 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110beta |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
(Homo sapiens (Human)) | BDBM50372473
(CHEMBL270638)Show SMILES CC(C#N)c1ccc(cc1)-n1c(C)nc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0| Show InChI InChI=1S/C27H19N5/c1-18(15-28)22-8-10-23(11-9-22)32-19(2)31-26-17-30-25-12-7-20(14-24(25)27(26)32)5-6-21-4-3-13-29-16-21/h3-4,7-14,16-18H,1-2H3 | 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 | 446 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110beta |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
(Homo sapiens (Human)) | BDBM50372472
(CHEMBL255592)Show SMILES Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)C#Cc1cccnc1 Show InChI InChI=1S/C28H21N5O/c1-28(2,18-29)21-9-11-22(12-10-21)33-26-23-15-19(6-7-20-5-4-14-30-16-20)8-13-24(23)31-17-25(26)32(3)27(33)34/h4-5,8-17H,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PI3K p110beta |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
3-phosphoinositide-dependent protein kinase 1
(Homo sapiens (Human)) | BDBM50372472
(CHEMBL255592)Show SMILES Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)C#Cc1cccnc1 Show InChI InChI=1S/C28H21N5O/c1-28(2,18-29)21-9-11-22(12-10-21)33-26-23-15-19(6-7-20-5-4-14-30-16-20)8-13-24(23)31-17-25(26)32(3)27(33)34/h4-5,8-17H,1-3H3 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of PDK1 |
Bioorg Med Chem Lett 18: 1027-30 (2008)
Article DOI: 10.1016/j.bmcl.2007.12.018
BindingDB Entry DOI: 10.7270/Q2GB24WG |
More data for this
Ligand-Target Pair | |
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