Found 67 hits Enz. Inhib. hit(s) with all data for entry = 50031139 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)) | BDBM50307954
(4-((4-Chlorobenzyloxy)methyl)-1-(7H-pyrrolo[2,3-d]...)Show SMILES NC1(COCc2ccc(Cl)cc2)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C19H22ClN5O/c20-15-3-1-14(2-4-15)11-26-12-19(21)6-9-25(10-7-19)18-16-5-8-22-17(16)23-13-24-18/h1-5,8,13H,6-7,9-12,21H2,(H,22,23,24) | PDB
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| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 0.590 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKB in human U87MG cells assessed as GSK3beta phosphorylation by ELISA |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50237622
(4-(4-Chlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4...)Show InChI InChI=1S/C18H20ClN5/c19-14-3-1-13(2-4-14)11-18(20)6-9-24(10-7-18)17-15-5-8-21-16(15)22-12-23-17/h1-5,8,12H,6-7,9-11,20H2,(H,21,22,23) | PDB
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| Article
PubMed
| n/a | n/a | 0.660 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKB in human U87MG cells assessed as GSK3beta phosphorylation by ELISA |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307955
(4-(2,4-Dichlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimid...)Show SMILES NC1(Cc2ccc(Cl)cc2Cl)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C18H19Cl2N5/c19-13-2-1-12(15(20)9-13)10-18(21)4-7-25(8-5-18)17-14-3-6-22-16(14)23-11-24-17/h1-3,6,9,11H,4-5,7-8,10,21H2,(H,22,23,24) | PDB
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| CHEMBL
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| Article
PubMed
| n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKB in human PC3M cells assessed as GSK3beta phosphorylation by ELISA |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307942
(4-Amino-N-(4-chlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyr...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(Cl)cc1 Show InChI InChI=1S/C19H21ClN6O/c20-14-3-1-13(2-4-14)11-23-18(27)19(21)6-9-26(10-7-19)17-15-5-8-22-16(15)24-12-25-17/h1-5,8,12H,6-7,9-11,21H2,(H,23,27)(H,22,24,25) | PDB
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| PDB
Article
PubMed
| n/a | n/a | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50237622
(4-(4-Chlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4...)Show InChI InChI=1S/C18H20ClN5/c19-14-3-1-13(2-4-14)11-18(20)6-9-24(10-7-18)17-15-5-8-21-16(15)22-12-23-17/h1-5,8,12H,6-7,9-11,20H2,(H,21,22,23) | PDB
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| Article
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| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKB in human PC3M cells assessed as GSK3beta phosphorylation by ELISA |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307956
(4-Amino-N-(2,4-dichlorobenzyl)-1-(7H-pyrrolo[2,3-d...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(Cl)cc1Cl Show InChI InChI=1S/C19H20Cl2N6O/c20-13-2-1-12(15(21)9-13)10-24-18(28)19(22)4-7-27(8-5-19)17-14-3-6-23-16(14)25-11-26-17/h1-3,6,9,11H,4-5,7-8,10,22H2,(H,24,28)(H,23,25,26) | PDB
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| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 3.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKB in human PC3M cells assessed as GSK3beta phosphorylation by ELISA |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307957
(4-Amino-N-(4-chloro-2-fluorobenzyl)-1-(7H-pyrrolo[...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(Cl)cc1F Show InChI InChI=1S/C19H20ClFN6O/c20-13-2-1-12(15(21)9-13)10-24-18(28)19(22)4-7-27(8-5-19)17-14-3-6-23-16(14)25-11-26-17/h1-3,6,9,11H,4-5,7-8,10,22H2,(H,24,28)(H,23,25,26) | PDB
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| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307975
(4-Amino-N-(4-chlorobenzyl)-N-methyl-1-(7H-pyrrolo[...)Show SMILES CN(Cc1ccc(Cl)cc1)C(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C20H23ClN6O/c1-26(12-14-2-4-15(21)5-3-14)19(28)20(22)7-10-27(11-8-20)18-16-6-9-23-17(16)24-13-25-18/h2-6,9,13H,7-8,10-12,22H2,1H3,(H,23,24,25) | PDB
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| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 4.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKB in human PC3M cells assessed as GSK3beta phosphorylation by ELISA |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307956
(4-Amino-N-(2,4-dichlorobenzyl)-1-(7H-pyrrolo[2,3-d...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(Cl)cc1Cl Show InChI InChI=1S/C19H20Cl2N6O/c20-13-2-1-12(15(21)9-13)10-24-18(28)19(22)4-7-27(8-5-19)17-14-3-6-23-16(14)25-11-26-17/h1-3,6,9,11H,4-5,7-8,10,22H2,(H,24,28)(H,23,25,26) | PDB
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 4.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307958
(4-Amino-N-(4-chlorobenzyl)-1-(8-oxo-8,9-dihydro-7H...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]c(=O)[nH]c12)C(=O)NCc1ccc(Cl)cc1 Show InChI InChI=1S/C18H20ClN7O2/c19-12-3-1-11(2-4-12)9-21-16(27)18(20)5-7-26(8-6-18)15-13-14(22-10-23-15)25-17(28)24-13/h1-4,10H,5-9,20H2,(H,21,27)(H2,22,23,24,25,28) | PDB
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antibodypedia
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| CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307959
(4-(4-Chlorobenzyl)-1-(1H-pyrrolo[2,3-b]pyridin-4-y...)Show InChI InChI=1S/C19H21ClN4/c20-15-3-1-14(2-4-15)13-19(21)7-11-24(12-8-19)17-6-10-23-18-16(17)5-9-22-18/h1-6,9-10H,7-8,11-13,21H2,(H,22,23) | PDB
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| CHEMBL
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 5.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307960
(4-Amino-N-(3,4-dichlorobenzyl)-1-(7H-pyrrolo[2,3-d...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C19H20Cl2N6O/c20-14-2-1-12(9-15(14)21)10-24-18(28)19(22)4-7-27(8-5-19)17-13-3-6-23-16(13)25-11-26-17/h1-3,6,9,11H,4-5,7-8,10,22H2,(H,24,28)(H,23,25,26) | PDB
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| n/a | n/a | 5.70 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50237622
(4-(4-Chlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4...)Show InChI InChI=1S/C18H20ClN5/c19-14-3-1-13(2-4-14)11-18(20)6-9-24(10-7-18)17-15-5-8-21-16(15)22-12-23-17/h1-5,8,12H,6-7,9-11,20H2,(H,21,22,23) | PDB
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| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307945
(4-(4-tert-Butylbenzyl)-1-(1H-pyrazolo[3,4-b]pyridi...)Show SMILES CC(C)(C)c1ccc(CC2(N)CCN(CC2)c2ccnc3[nH]ncc23)cc1 Show InChI InChI=1S/C22H29N5/c1-21(2,3)17-6-4-16(5-7-17)14-22(23)9-12-27(13-10-22)19-8-11-24-20-18(19)15-25-26-20/h4-8,11,15H,9-10,12-14,23H2,1-3H3,(H,24,25,26) | PDB
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| n/a | n/a | 6.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKB in human U87MG cells assessed as GSK3beta phosphorylation by ELISA |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307962
(4-Amino-N-(3-chlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyr...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1cccc(Cl)c1 Show InChI InChI=1S/C19H21ClN6O/c20-14-3-1-2-13(10-14)11-23-18(27)19(21)5-8-26(9-6-19)17-15-4-7-22-16(15)24-12-25-17/h1-4,7,10,12H,5-6,8-9,11,21H2,(H,23,27)(H,22,24,25) | PDB
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| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307961
(4-(Naphthalen-2-ylmethyl)-1-(7H-pyrrolo[2,3-d]pyri...)Show SMILES NC1(Cc2ccc3ccccc3c2)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C22H23N5/c23-22(14-16-5-6-17-3-1-2-4-18(17)13-16)8-11-27(12-9-22)21-19-7-10-24-20(19)25-15-26-21/h1-7,10,13,15H,8-9,11-12,14,23H2,(H,24,25,26) | PDB
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| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307966
(4-Amino-N-(4-chlorobenzyl)-1-(1H-pyrrolo[2,3-b]pyr...)Show SMILES NC1(CCN(CC1)c1ccnc2[nH]ccc12)C(=O)NCc1ccc(Cl)cc1 Show InChI InChI=1S/C20H22ClN5O/c21-15-3-1-14(2-4-15)13-25-19(27)20(22)7-11-26(12-8-20)17-6-10-24-18-16(17)5-9-23-18/h1-6,9-10H,7-8,11-13,22H2,(H,23,24)(H,25,27) | PDB
UniProtKB/SwissProt
antibodypedia
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AffyNet
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PC cid
PC sid
UniChem
| Article
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| n/a | n/a | 7.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKB in human U87MG cells assessed as GSK3beta phosphorylation by ELISA |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307963
(4-Amino-N-(2-chloro-4-fluorobenzyl)-1-(7H-pyrrolo[...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(F)cc1Cl Show InChI InChI=1S/C19H20ClFN6O/c20-15-9-13(21)2-1-12(15)10-24-18(28)19(22)4-7-27(8-5-19)17-14-3-6-23-16(14)25-11-26-17/h1-3,6,9,11H,4-5,7-8,10,22H2,(H,24,28)(H,23,25,26) | PDB
UniProtKB/SwissProt
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PC cid
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UniChem
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307954
(4-((4-Chlorobenzyloxy)methyl)-1-(7H-pyrrolo[2,3-d]...)Show SMILES NC1(COCc2ccc(Cl)cc2)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C19H22ClN5O/c20-15-3-1-14(2-4-15)11-26-12-19(21)6-9-25(10-7-19)18-16-5-8-22-17(16)23-13-24-18/h1-5,8,13H,6-7,9-12,21H2,(H,22,23,24) | PDB
UniProtKB/SwissProt
antibodypedia
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
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PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307955
(4-(2,4-Dichlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimid...)Show SMILES NC1(Cc2ccc(Cl)cc2Cl)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C18H19Cl2N5/c19-13-2-1-12(15(20)9-13)10-18(21)4-7-25(8-5-18)17-14-3-6-22-16(14)23-11-24-17/h1-3,6,9,11H,4-5,7-8,10,21H2,(H,22,23,24) | PDB
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| n/a | n/a | 8.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307965
(4-Amino-N-(2,4-difluorobenzyl)-1-(7H-pyrrolo[2,3-d...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(F)cc1F Show InChI InChI=1S/C19H20F2N6O/c20-13-2-1-12(15(21)9-13)10-24-18(28)19(22)4-7-27(8-5-19)17-14-3-6-23-16(14)25-11-26-17/h1-3,6,9,11H,4-5,7-8,10,22H2,(H,24,28)(H,23,25,26) | PDB
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Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307964
(4-Amino-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N-(4-(...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C20H21F3N6O/c21-20(22,23)14-3-1-13(2-4-14)11-26-18(30)19(24)6-9-29(10-7-19)17-15-5-8-25-16(15)27-12-28-17/h1-5,8,12H,6-7,9-11,24H2,(H,26,30)(H,25,27,28) | PDB
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| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307967
(4-(4-Chlorobenzyl)-1-(1H-pyrazolo[3,4-b]pyridin-4-...)Show InChI InChI=1S/C18H20ClN5/c19-14-3-1-13(2-4-14)11-18(20)6-9-24(10-7-18)16-5-8-21-17-15(16)12-22-23-17/h1-5,8,12H,6-7,9-11,20H2,(H,21,22,23) | PDB
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| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307966
(4-Amino-N-(4-chlorobenzyl)-1-(1H-pyrrolo[2,3-b]pyr...)Show SMILES NC1(CCN(CC1)c1ccnc2[nH]ccc12)C(=O)NCc1ccc(Cl)cc1 Show InChI InChI=1S/C20H22ClN5O/c21-15-3-1-14(2-4-15)13-25-19(27)20(22)7-11-26(12-8-20)17-6-10-24-18-16(17)5-9-23-18/h1-6,9-10H,7-8,11-13,22H2,(H,23,24)(H,25,27) | PDB
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| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307968
(4-Amino-N-(4-fluorobenzyl)-1-(7H-pyrrolo[2,3-d]pyr...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(F)cc1 Show InChI InChI=1S/C19H21FN6O/c20-14-3-1-13(2-4-14)11-23-18(27)19(21)6-9-26(10-7-19)17-15-5-8-22-16(15)24-12-25-17/h1-5,8,12H,6-7,9-11,21H2,(H,23,27)(H,22,24,25) | PDB
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| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307969
(4-(3-Methoxybenzyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-...)Show InChI InChI=1S/C19H23N5O/c1-25-15-4-2-3-14(11-15)12-19(20)6-9-24(10-7-19)18-16-5-8-21-17(16)22-13-23-18/h2-5,8,11,13H,6-7,9-10,12,20H2,1H3,(H,21,22,23) | PDB
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Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307970
(4-(2,5-Dichlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimid...)Show SMILES NC1(Cc2cc(Cl)ccc2Cl)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C18H19Cl2N5/c19-13-1-2-15(20)12(9-13)10-18(21)4-7-25(8-5-18)17-14-3-6-22-16(14)23-11-24-17/h1-3,6,9,11H,4-5,7-8,10,21H2,(H,22,23,24) | PDB
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| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307971
(4-(3,4-Dichlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimid...)Show SMILES NC1(Cc2ccc(Cl)c(Cl)c2)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C18H19Cl2N5/c19-14-2-1-12(9-15(14)20)10-18(21)4-7-25(8-5-18)17-13-3-6-22-16(13)23-11-24-17/h1-3,6,9,11H,4-5,7-8,10,21H2,(H,22,23,24) | PDB
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| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307972
(4-(3-(Trifluoromethoxy)benzyl)-1-(7H-pyrrolo[2,3-d...)Show SMILES NC1(Cc2cccc(OC(F)(F)F)c2)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C19H20F3N5O/c20-19(21,22)28-14-3-1-2-13(10-14)11-18(23)5-8-27(9-6-18)17-15-4-7-24-16(15)25-12-26-17/h1-4,7,10,12H,5-6,8-9,11,23H2,(H,24,25,26) | PDB
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| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307973
(4-(2,6-Dichlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimid...)Show SMILES NC1(Cc2c(Cl)cccc2Cl)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C18H19Cl2N5/c19-14-2-1-3-15(20)13(14)10-18(21)5-8-25(9-6-18)17-12-4-7-22-16(12)23-11-24-17/h1-4,7,11H,5-6,8-10,21H2,(H,22,23,24) | PDB
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| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307974
(4-(Naphthalen-1-ylmethyl)-1-(7H-pyrrolo[2,3-d]pyri...)Show SMILES NC1(Cc2cccc3ccccc23)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C22H23N5/c23-22(14-17-6-3-5-16-4-1-2-7-18(16)17)9-12-27(13-10-22)21-19-8-11-24-20(19)25-15-26-21/h1-8,11,15H,9-10,12-14,23H2,(H,24,25,26) | PDB
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| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307975
(4-Amino-N-(4-chlorobenzyl)-N-methyl-1-(7H-pyrrolo[...)Show SMILES CN(Cc1ccc(Cl)cc1)C(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C20H23ClN6O/c1-26(12-14-2-4-15(21)5-3-14)19(28)20(22)7-10-27(11-8-20)18-16-6-9-23-17(16)24-13-25-18/h2-6,9,13H,7-8,10-12,22H2,1H3,(H,23,24,25) | PDB
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| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307943
(4-(4-tert-Butylbenzyl)-1-(7H-pyrrolo[2,3-d]pyrimid...)Show SMILES CC(C)(C)c1ccc(CC2(N)CCN(CC2)c2ncnc3[nH]ccc23)cc1 Show InChI InChI=1S/C22H29N5/c1-21(2,3)17-6-4-16(5-7-17)14-22(23)9-12-27(13-10-22)20-18-8-11-24-19(18)25-15-26-20/h4-8,11,15H,9-10,12-14,23H2,1-3H3,(H,24,25,26) | PDB
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| n/a | n/a | 27 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307976
(4-Amino-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N-(4-(...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C20H21F3N6O2/c21-20(22,23)31-14-3-1-13(2-4-14)11-26-18(30)19(24)6-9-29(10-7-19)17-15-5-8-25-16(15)27-12-28-17/h1-5,8,12H,6-7,9-11,24H2,(H,26,30)(H,25,27,28) | PDB
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Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307977
(4-(4-tert-Butylbenzyl)-1-(1H-pyrrolo[2,3-b]pyridin...)Show SMILES CC(C)(C)c1ccc(CC2(N)CCN(CC2)c2ccnc3[nH]ccc23)cc1 Show InChI InChI=1S/C23H30N4/c1-22(2,3)18-6-4-17(5-7-18)16-23(24)10-14-27(15-11-23)20-9-13-26-21-19(20)8-12-25-21/h4-9,12-13H,10-11,14-16,24H2,1-3H3,(H,25,26) | PDB
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| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307979
(4-(2,3-Dichlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimid...)Show SMILES NC1(Cc2cccc(Cl)c2Cl)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C18H19Cl2N5/c19-14-3-1-2-12(15(14)20)10-18(21)5-8-25(9-6-18)17-13-4-7-22-16(13)23-11-24-17/h1-4,7,11H,5-6,8-10,21H2,(H,22,23,24) | PDB
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| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307978
(4-(4-(Trifluoromethoxy)benzyl)-1-(7H-pyrrolo[2,3-d...)Show SMILES NC1(Cc2ccc(OC(F)(F)F)cc2)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C19H20F3N5O/c20-19(21,22)28-14-3-1-13(2-4-14)11-18(23)6-9-27(10-7-18)17-15-5-8-24-16(15)25-12-26-17/h1-5,8,12H,6-7,9-11,23H2,(H,24,25,26) | PDB
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| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307980
(4-Amino-N-(2-chlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyr...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccccc1Cl Show InChI InChI=1S/C19H21ClN6O/c20-15-4-2-1-3-13(15)11-23-18(27)19(21)6-9-26(10-7-19)17-14-5-8-22-16(14)24-12-25-17/h1-5,8,12H,6-7,9-11,21H2,(H,23,27)(H,22,24,25) | PDB
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Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307981
(4-(2-Chlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4...)Show InChI InChI=1S/C18H20ClN5/c19-15-4-2-1-3-13(15)11-18(20)6-9-24(10-7-18)17-14-5-8-21-16(14)22-12-23-17/h1-5,8,12H,6-7,9-11,20H2,(H,21,22,23) | PDB
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| n/a | n/a | 44 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307982
(4-(3-Chlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4...)Show InChI InChI=1S/C18H20ClN5/c19-14-3-1-2-13(10-14)11-18(20)5-8-24(9-6-18)17-15-4-7-21-16(15)22-12-23-17/h1-4,7,10,12H,5-6,8-9,11,20H2,(H,21,22,23) | PDB
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PubMed
| n/a | n/a | 46 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307958
(4-Amino-N-(4-chlorobenzyl)-1-(8-oxo-8,9-dihydro-7H...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]c(=O)[nH]c12)C(=O)NCc1ccc(Cl)cc1 Show InChI InChI=1S/C18H20ClN7O2/c19-12-3-1-11(2-4-12)9-21-16(27)18(20)5-7-26(8-6-18)15-13-14(22-10-23-15)25-17(28)24-13/h1-4,10H,5-9,20H2,(H,21,27)(H2,22,23,24,25,28) | PDB
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| n/a | n/a | >50 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKB in human U87MG cells assessed as GSK3beta phosphorylation by ELISA |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307944
(6-(4-Amino-4-(2,4-dichlorobenzyl)piperidin-1-yl)-7...)Show SMILES NC1(Cc2ccc(Cl)cc2Cl)CCN(CC1)c1ncnc2[nH]c(=O)[nH]c12 Show InChI InChI=1S/C17H18Cl2N6O/c18-11-2-1-10(12(19)7-11)8-17(20)3-5-25(6-4-17)15-13-14(21-9-22-15)24-16(26)23-13/h1-2,7,9H,3-6,8,20H2,(H2,21,22,23,24,26) | PDB
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PubMed
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307945
(4-(4-tert-Butylbenzyl)-1-(1H-pyrazolo[3,4-b]pyridi...)Show SMILES CC(C)(C)c1ccc(CC2(N)CCN(CC2)c2ccnc3[nH]ncc23)cc1 Show InChI InChI=1S/C22H29N5/c1-21(2,3)17-6-4-16(5-7-17)14-22(23)9-12-27(13-10-22)19-8-11-24-20-18(19)15-25-26-20/h4-8,11,15H,9-10,12-14,23H2,1-3H3,(H,24,25,26) | PDB
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| n/a | n/a | 58 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307946
(CHEMBL603244 | N-((4-Amino-1-(7H-pyrrolo[2,3-d]pyr...)Show SMILES NC1(CNC(=O)c2ccc(Cl)cc2)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C19H21ClN6O/c20-14-3-1-13(2-4-14)18(27)23-11-19(21)6-9-26(10-7-19)17-15-5-8-22-16(15)24-12-25-17/h1-5,8,12H,6-7,9-11,21H2,(H,23,27)(H,22,24,25) | PDB
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| Article
PubMed
| n/a | n/a | 69 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307947
(6-(4-Amino-4-(4-tert-butylbenzyl)piperidin-1-yl)-7...)Show SMILES CC(C)(C)c1ccc(CC2(N)CCN(CC2)c2ncnc3[nH]c(=O)[nH]c23)cc1 Show InChI InChI=1S/C21H28N6O/c1-20(2,3)15-6-4-14(5-7-15)12-21(22)8-10-27(11-9-21)18-16-17(23-13-24-18)26-19(28)25-16/h4-7,13H,8-12,22H2,1-3H3,(H2,23,24,25,26,28) | PDB
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PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307948
(4-(2-(Trifluoromethoxy)benzyl)-1-(7H-pyrrolo[2,3-d...)Show SMILES NC1(Cc2ccccc2OC(F)(F)F)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C19H20F3N5O/c20-19(21,22)28-15-4-2-1-3-13(15)11-18(23)6-9-27(10-7-18)17-14-5-8-24-16(14)25-12-26-17/h1-5,8,12H,6-7,9-11,23H2,(H,24,25,26) | PDB
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PubMed
| n/a | n/a | 84 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307949
(4-(2-Chloro-4-fluorobenzyl)-1-(7H-pyrrolo[2,3-d]py...)Show SMILES NC1(Cc2ccc(F)cc2Cl)CCN(CC1)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C18H19ClFN5/c19-15-9-13(20)2-1-12(15)10-18(21)4-7-25(8-5-18)17-14-3-6-22-16(14)23-11-24-17/h1-3,6,9,11H,4-5,7-8,10,21H2,(H,22,23,24) | PDB
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| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307950
(4-Amino-N-(4-tert-butylbenzyl)-1-(7H-pyrrolo[2,3-d...)Show SMILES CC(C)(C)c1ccc(CNC(=O)C2(N)CCN(CC2)c2ncnc3[nH]ccc23)cc1 Show InChI InChI=1S/C23H30N6O/c1-22(2,3)17-6-4-16(5-7-17)14-26-21(30)23(24)9-12-29(13-10-23)20-18-8-11-25-19(18)27-15-28-20/h4-8,11,15H,9-10,12-14,24H2,1-3H3,(H,26,30)(H,25,27,28) | PDB
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| n/a | n/a | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM50307951
((4-Amino-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperi...)Show SMILES NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N1CCc2ccccc2C1 Show InChI InChI=1S/C21H24N6O/c22-21(20(28)27-10-6-15-3-1-2-4-16(15)13-27)7-11-26(12-8-21)19-17-5-9-23-18(17)24-14-25-19/h1-5,9,14H,6-8,10-13,22H2,(H,23,24,25) | PDB
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| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
RAC-beta serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM15211
(CHEMBL104264 | H-89 | H89 | HT-89 (H-89) | N-(2-{[...)Show SMILES Brc1ccc(\C=C\CNCCNS(=O)(=O)c2cccc3cnccc23)cc1 Show InChI InChI=1S/C20H20BrN3O2S/c21-18-8-6-16(7-9-18)3-2-11-22-13-14-24-27(25,26)20-5-1-4-17-15-23-12-10-19(17)20/h1-10,12,15,22,24H,11,13-14H2/b3-2+ | PDB
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| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of PKBbeta by radiometric filter binding assay |
J Med Chem 53: 2239-49 (2010)
Article DOI: 10.1021/jm901788j
BindingDB Entry DOI: 10.7270/Q23B608V |
More data for this
Ligand-Target Pair | |
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