Found 104 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 |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267760
![PNG](/data/jpeg/tenK5026/BindingDB_50267760.png) (3-Benzofuran-3-yl-4-(7-methoxymethyl-1-methyl-1H-i...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C23H18N2O4/c1-25-10-16(15-8-5-6-13(11-28-2)21(15)25)19-20(23(27)24-22(19)26)17-12-29-18-9-4-3-7-14(17)18/h3-10,12H,11H2,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 0.230 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267461
![PNG](/data/jpeg/tenK5026/BindingDB_50267461.png) (3-(5-Fluoro-1-methyl-1H-indol-3-yl)-4-(6-hydroxyme...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)ccc12 |t:4| Show InChI InChI=1S/C22H15FN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 0.350 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase Chk1
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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| PDB Article PubMed
| n/a | n/a | <0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CHK1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267607
![PNG](/data/jpeg/tenK5026/BindingDB_50267607.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 0.510 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
RAC-gamma serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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Similars
| Article PubMed
| n/a | n/a | 0.640 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of AKT3 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267800
![PNG](/data/jpeg/tenK5026/BindingDB_50267800.png) (3-(6-Hydroxymethylbenzofuran-3-yl)-4-(7-methoxymet...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2cc(CO)ccc12 |t:15| Show InChI InChI=1S/C24H20N2O5/c1-26-9-17(16-5-3-4-14(11-30-2)22(16)26)20-21(24(29)25-23(20)28)18-12-31-19-8-13(10-27)6-7-15(18)19/h3-9,12,27H,10-11H2,1-2H3,(H,25,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 0.730 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267523
![PNG](/data/jpeg/tenK5026/BindingDB_50267523.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(6-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 0.950 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267802
![PNG](/data/jpeg/tenK5026/BindingDB_50267802.png) (3-[3-(4-Benzofuran-3-yl-2,5-dioxo-2,5-dihydro-1H-p...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2cccc(CCC(O)=O)c12 |t:4| Show InChI InChI=1S/C24H18N2O5/c1-26-11-16(15-7-4-5-13(22(15)26)9-10-19(27)28)20-21(24(30)25-23(20)29)17-12-31-18-8-3-2-6-14(17)18/h2-8,11-12H,9-10H2,1H3,(H,27,28)(H,25,29,30) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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Patents
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| Article PubMed
| n/a | n/a | 1.40 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin A |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (docked) |
Cyclin-dependent kinase 1
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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Patents
Similars
| Article PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK1/Cyclin B |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 9
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
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Patents
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| Article PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK9/cyclin T1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267520
![PNG](/data/jpeg/tenK5026/BindingDB_50267520.png) (3-(5-Fluoro-1-methyl-1H-indol-3-yl)-4-(6-hydroxybe...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(O)ccc23)c2cc(F)ccc12 |t:4| Show InChI InChI=1S/C21H13FN2O4/c1-24-8-14(13-6-10(22)2-5-16(13)24)18-19(21(27)23-20(18)26)15-9-28-17-7-11(25)3-4-12(15)17/h2-9,25H,1H3,(H,23,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 5
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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Patents
Similars
| Article PubMed
| n/a | n/a | 3.80 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK5/P35 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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Patents
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| Article PubMed
| n/a | n/a | 3.80 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (docked) |
Cyclin-dependent kinase 5
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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| Article PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK5/P25 (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267759
![PNG](/data/jpeg/tenK5026/BindingDB_50267759.png) (3-(6-Hydroxymethylbenzofuran-3-yl)-4-(7-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cccc(CO)c12 |t:4| Show InChI InChI=1S/C23H18N2O5/c1-25-8-16(15-4-2-3-13(10-27)21(15)25)19-20(23(29)24-22(19)28)17-11-30-18-7-12(9-26)5-6-14(17)18/h2-8,11,26-27H,9-10H2,1H3,(H,24,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 5.10 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267758
![PNG](/data/jpeg/tenK5026/BindingDB_50267758.png) (3-Benzofuran-3-yl-4-(7-hydroxymethyl-1-methyl-1H-i...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2cccc(CO)c12 |t:4| Show InChI InChI=1S/C22H16N2O4/c1-24-9-15(14-7-4-5-12(10-25)20(14)24)18-19(22(27)23-21(18)26)16-11-28-17-8-3-2-6-13(16)17/h2-9,11,25H,10H2,1H3,(H,23,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 5.40 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 3
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem
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Similars
| Article PubMed
| n/a | n/a | 6.90 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK3/Cyclin E |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267605
![PNG](/data/jpeg/tenK5026/BindingDB_50267605.png) (3-(benzofuran-3-yl)-4-(5-bromo-1-methyl-1H-indol-3...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C21H13BrN2O3/c1-24-9-14(13-8-11(22)6-7-16(13)24)18-19(21(26)23-20(18)25)15-10-27-17-5-3-2-4-12(15)17/h2-10H,1H3,(H,23,25,26) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE PC cid PC sid UniChem
Patents
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| Article PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267606
![PNG](/data/jpeg/tenK5026/BindingDB_50267606.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(7-methoxyben...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2ccc(Br)cc12 |t:13| Show InChI InChI=1S/C22H15BrN2O4/c1-25-9-14(13-8-11(23)6-7-16(13)25)18-19(22(27)24-21(18)26)15-10-29-20-12(15)4-3-5-17(20)28-2/h3-10H,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 7.5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267801
![PNG](/data/jpeg/tenK5026/BindingDB_50267801.png) (3-[3-(4-Benzofuran-3-yl-2,5-dioxo-2,5-dihydro-1H-p...)Show SMILES CCOC(=O)CCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:19| Show InChI InChI=1S/C26H22N2O5/c1-3-32-21(29)12-11-15-7-6-9-17-18(13-28(2)24(15)17)22-23(26(31)27-25(22)30)19-14-33-20-10-5-4-8-16(19)20/h4-10,13-14H,3,11-12H2,1-2H3,(H,27,30,31) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267678
![PNG](/data/jpeg/tenK5026/BindingDB_50267678.png) (3-[4-(6-Hydroxymethylbenzofuran-3-yl)-2,5-dioxo-2,...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(ccc12)C#N |t:4| Show InChI InChI=1S/C23H15N3O4/c1-26-9-16(15-6-12(8-24)3-5-18(15)26)20-21(23(29)25-22(20)28)17-11-30-19-7-13(10-27)2-4-14(17)19/h2-7,9,11,27H,10H2,1H3,(H,25,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267367
![PNG](/data/jpeg/tenK5026/BindingDB_50267367.png) (3-(benzofuran-3-yl)-4-(6-hydroxy-1-methyl-1H-indol...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2ccc(O)cc12 |t:4| Show InChI InChI=1S/C21H14N2O4/c1-23-9-14(12-7-6-11(24)8-16(12)23)18-19(21(26)22-20(18)25)15-10-27-17-5-3-2-4-13(15)17/h2-10,24H,1H3,(H,22,25,26) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267715
![PNG](/data/jpeg/tenK5026/BindingDB_50267715.png) (3-(5-Cyclopropylethynyl-1-methyl-1H-indol-3-yl)-4-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccc(F)cc23)c2cc(ccc12)C#CC1CC1 |t:4| Show InChI InChI=1S/C26H17FN2O3/c1-29-12-19(17-10-15(6-8-21(17)29)5-4-14-2-3-14)23-24(26(31)28-25(23)30)20-13-32-22-9-7-16(27)11-18(20)22/h6-14H,2-3H2,1H3,(H,28,30,31) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 4
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK4/Cyclin D1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267462
![PNG](/data/jpeg/tenK5026/BindingDB_50267462.png) (3-(5-Fluoro-1-methyl-1H-indol-3-yl)-4-(6-methoxyme...)Show SMILES COCc1ccc2c(coc2c1)C1=C(C(=O)NC1=O)c1cn(C)c2ccc(F)cc12 |t:14| Show InChI InChI=1S/C23H17FN2O4/c1-26-9-16(15-8-13(24)4-6-18(15)26)20-21(23(28)25-22(20)27)17-11-30-19-7-12(10-29-2)3-5-14(17)19/h3-9,11H,10H2,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| 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 |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267639
![PNG](/data/jpeg/tenK5026/BindingDB_50267639.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-prop-2-yny...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(OCC#C)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C24H15BrN2O4/c1-3-8-30-14-5-6-15-18(12-31-20(15)10-14)22-21(23(28)26-24(22)29)17-11-27(2)19-7-4-13(25)9-16(17)19/h1,4-7,9-12H,8H2,2H3,(H,26,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267759
![PNG](/data/jpeg/tenK5026/BindingDB_50267759.png) (3-(6-Hydroxymethylbenzofuran-3-yl)-4-(7-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cccc(CO)c12 |t:4| Show InChI InChI=1S/C23H18N2O5/c1-25-8-16(15-4-2-3-13(10-27)21(15)25)19-20(23(29)24-22(19)28)17-11-30-18-7-12(9-26)5-6-14(17)18/h2-8,11,26-27H,9-10H2,1H3,(H,24,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 27 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM2600
![PNG](/data/jpeg/tenK0/BindingDB_2600.png) ((Arylindolyl)maleimide deriv. 22 | 3-(1-benzofuran...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2ccccc12 |t:4| Show InChI InChI=1S/C21H14N2O3/c1-23-10-14(12-6-2-4-8-16(12)23)18-19(21(25)22-20(18)24)15-11-26-17-9-5-3-7-13(15)17/h2-11H,1H3,(H,22,24,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| 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 |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267676
![PNG](/data/jpeg/tenK5026/BindingDB_50267676.png) (3-Benzofuran-3-yl-4-(5-iodo-1-methyl-1H-indol-3-yl...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2cc(I)ccc12 |t:4| Show InChI InChI=1S/C21H13IN2O3/c1-24-9-14(13-8-11(22)6-7-16(13)24)18-19(21(26)23-20(18)25)15-10-27-17-5-3-2-4-12(15)17/h2-10H,1H3,(H,23,25,26) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| 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 |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267642
![PNG](/data/jpeg/tenK5026/BindingDB_50267642.png) (3-(5-chloro-1-methyl-1H-indol-3-yl)-4-(5-fluoroben...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccc(F)cc23)c2cc(Cl)ccc12 |t:4| Show InChI InChI=1S/C21H12ClFN2O3/c1-25-8-14(12-6-10(22)2-4-16(12)25)18-19(21(27)24-20(18)26)15-9-28-17-5-3-11(23)7-13(15)17/h2-9H,1H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50229962
![PNG](/data/jpeg/tenK5022/BindingDB_50229962.png) (1-(4-methoxybenzyl)-3-(5-nitrothiazol-2-yl)urea | ...)Show InChI InChI=1S/C12H12N4O4S/c1-20-9-4-2-8(3-5-9)6-13-11(17)15-12-14-7-10(21-12)16(18)19/h2-5,7H,6H2,1H3,(H2,13,14,15,17) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem
Patents
| MMDB PDB Article PubMed
| n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267640
![PNG](/data/jpeg/tenK5026/BindingDB_50267640.png) (3-(6-Allyloxybenzofuran-3-yl)-4-(5-bromo-1-methyl-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(OCC=C)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C24H17BrN2O4/c1-3-8-30-14-5-6-15-18(12-31-20(15)10-14)22-21(23(28)26-24(22)29)17-11-27(2)19-7-4-13(25)9-16(17)19/h3-7,9-12H,1,8H2,2H3,(H,26,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM8296
![PNG](/data/jpeg/tenK0/BindingDB_8296.png) (3-(2,4-dichlorophenyl)-4-(1-methyl-1H-indol-3-yl)-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2ccc(Cl)cc2Cl)c2ccccc12 |t:4| Show InChI InChI=1S/C19H12Cl2N2O2/c1-23-9-13(11-4-2-3-5-15(11)23)17-16(18(24)22-19(17)25)12-7-6-10(20)8-14(12)21/h2-9H,1H3,(H,22,24,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267803
![PNG](/data/jpeg/tenK5026/BindingDB_50267803.png) (3-(benzofuran-3-yl)-4-(7-hydroxy-1-methyl-1H-indol...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2cccc(O)c12 |t:4| Show InChI InChI=1S/C21H14N2O4/c1-23-9-13(12-6-4-7-15(24)19(12)23)17-18(21(26)22-20(17)25)14-10-27-16-8-3-2-5-11(14)16/h2-10,24H,1H3,(H,22,25,26) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 55 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267675
![PNG](/data/jpeg/tenK5026/BindingDB_50267675.png) (3-(5,7-Dibromo-1-methyl-1H-indol-3-yl)-4-(7-methox...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2c(Br)cc(Br)cc12 |t:13| Show InChI InChI=1S/C22H14Br2N2O4/c1-26-8-13(12-6-10(23)7-15(24)19(12)26)17-18(22(28)25-21(17)27)14-9-30-20-11(14)4-3-5-16(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 89 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 6
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 116 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK6/cyclin D3 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267758
![PNG](/data/jpeg/tenK5026/BindingDB_50267758.png) (3-Benzofuran-3-yl-4-(7-hydroxymethyl-1-methyl-1H-i...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2cccc(CO)c12 |t:4| Show InChI InChI=1S/C22H16N2O4/c1-24-9-15(14-7-4-5-12(10-25)20(14)24)18-19(22(27)23-21(18)26)16-11-28-17-8-3-2-6-13(16)17/h2-9,11,25H,10H2,1H3,(H,23,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 149 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267677
![PNG](/data/jpeg/tenK5026/BindingDB_50267677.png) (3-(5-Fluorobenzofuran-3-yl)-4-(5-iodo-1-methyl-1H-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccc(F)cc23)c2cc(I)ccc12 |t:4| Show InChI InChI=1S/C21H12FIN2O3/c1-25-8-14(12-7-11(23)3-4-16(12)25)18-19(21(27)24-20(18)26)15-9-28-17-5-2-10(22)6-13(15)17/h2-9H,1H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267522
![PNG](/data/jpeg/tenK5026/BindingDB_50267522.png) (3-Benzofuran-3-yl-4-(6-chloro-5-fluoro-1-methyl-1H...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C21H12ClFN2O3/c1-25-8-12(11-6-15(23)14(22)7-16(11)25)18-19(21(27)24-20(18)26)13-9-28-17-5-3-2-4-10(13)17/h2-9H,1H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 184 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267718
![PNG](/data/jpeg/tenK5026/BindingDB_50267718.png) (3-Benzofuran-3-yl-4-(6-iodo-5-methoxy-1-methyl-1H-...)Show SMILES COc1cc2c(cn(C)c2cc1I)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C22H15IN2O4/c1-25-9-13(12-7-18(28-2)15(23)8-16(12)25)19-20(22(27)24-21(19)26)14-10-29-17-6-4-3-5-11(14)17/h3-10H,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 223 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Inhibitor of nuclear factor kappa-B kinase subunit alpha
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 233 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of IKKalpha |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267679
![PNG](/data/jpeg/tenK5026/BindingDB_50267679.png) (3-(benzofuran-3-yl)-4-(5-cyclopropyl-1-methyl-1H-i...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2cc(ccc12)C1CC1 |t:4| Show InChI InChI=1S/C24H18N2O3/c1-26-11-17(16-10-14(13-6-7-13)8-9-19(16)26)21-22(24(28)25-23(21)27)18-12-29-20-5-3-2-4-15(18)20/h2-5,8-13H,6-7H2,1H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 235 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267461
![PNG](/data/jpeg/tenK5026/BindingDB_50267461.png) (3-(5-Fluoro-1-methyl-1H-indol-3-yl)-4-(6-hydroxyme...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)ccc12 |t:4| Show InChI InChI=1S/C22H15FN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 237 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267521
![PNG](/data/jpeg/tenK5026/BindingDB_50267521.png) (3-(5-Fluoro-6-iodo-1-methyl-1H-indol-3-yl)-4-(7-me...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(I)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14FIN2O4/c1-26-8-12(11-6-14(23)15(24)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 247 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267565
![PNG](/data/jpeg/tenK5026/BindingDB_50267565.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(7-...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-12(11-6-15(24)14(23)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 260 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267845
![PNG](/data/jpeg/tenK5026/BindingDB_50267845.png) (3-(5,6-Difluorobenzofuran-3-yl)-4-(1-methyl-1H-ben...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(F)c(F)cc23)c2ccc3ccccc3c12 |t:4| Show InChI InChI=1S/C25H14F2N2O3/c1-29-10-16(14-7-6-12-4-2-3-5-13(12)23(14)29)21-22(25(31)28-24(21)30)17-11-32-20-9-19(27)18(26)8-15(17)20/h2-11H,1H3,(H,28,30,31) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 314 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267641
![PNG](/data/jpeg/tenK5026/BindingDB_50267641.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-[6-(4-methoxy...)Show SMILES COc1ccc(COc2ccc3c(coc3c2)C2=C(C(=O)NC2=O)c2cn(C)c3ccc(Br)cc23)cc1 |t:19| Show InChI InChI=1S/C29H21BrN2O5/c1-32-13-22(21-11-17(30)5-10-24(21)32)26-27(29(34)31-28(26)33)23-15-37-25-12-19(8-9-20(23)25)36-14-16-3-6-18(35-2)7-4-16/h3-13,15H,14H2,1-2H3,(H,31,33,34) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 335 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267607
![PNG](/data/jpeg/tenK5026/BindingDB_50267607.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 337 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267717
![PNG](/data/jpeg/tenK5026/BindingDB_50267717.png) (3-Benzofuran-3-yl-4-(6-chloro-5-methoxy-1-methyl-1...)Show SMILES COc1cc2c(cn(C)c2cc1Cl)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C22H15ClN2O4/c1-25-9-13(12-7-18(28-2)15(23)8-16(12)25)19-20(22(27)24-21(19)26)14-10-29-17-6-4-3-5-11(14)17/h3-10H,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 440 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 6
(Homo sapiens (Human)) | BDBM50267607
![PNG](/data/jpeg/tenK5026/BindingDB_50267607.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 510 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK6/cyclin D3 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267607
![PNG](/data/jpeg/tenK5026/BindingDB_50267607.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 550 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin A |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267716
![PNG](/data/jpeg/tenK5026/BindingDB_50267716.png) (3-(5-Fluorobenzofuran-3-yl)-4-(5-methyl-5H-[1,3]di...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccc(F)cc23)c2cc3OCOc3cc12 |t:4| Show InChI InChI=1S/C22H13FN2O5/c1-25-7-13(11-5-17-18(6-15(11)25)30-9-29-17)19-20(22(27)24-21(19)26)14-8-28-16-3-2-10(23)4-12(14)16/h2-8H,9H2,1H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 710 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Inhibitor of nuclear factor kappa-B kinase subunit beta
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 771 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of IKK-beta |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267757
![PNG](/data/jpeg/tenK5026/BindingDB_50267757.png) (3-(7-Methoxybenzofuran-3-yl)-4-(1-methyl-6-trifluo...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(ccc12)C(F)(F)F |t:13| Show InChI InChI=1S/C23H15F3N2O4/c1-28-9-14(12-7-6-11(8-16(12)28)23(24,25)26)18-19(22(30)27-21(18)29)15-10-32-20-13(15)4-3-5-17(20)31-2/h3-10H,1-2H3,(H,27,29,30) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 830 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267562
![PNG](/data/jpeg/tenK5026/BindingDB_50267562.png) (3-(6-Chloro-5-methoxy-1-methyl-1H-indol-3-yl)-4-(6...)Show SMILES COc1ccc2c(coc2c1)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-13(12-6-16(24)15(23)7-17(12)26)19-20(22(28)25-21(19)27)14-9-30-18-5-10(29-2)3-4-11(14)18/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 870 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 1
(Homo sapiens (Human)) | BDBM50267607
![PNG](/data/jpeg/tenK5026/BindingDB_50267607.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 930 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK1/Cyclin B |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267676
![PNG](/data/jpeg/tenK5026/BindingDB_50267676.png) (3-Benzofuran-3-yl-4-(5-iodo-1-methyl-1H-indol-3-yl...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2cc(I)ccc12 |t:4| Show InChI InChI=1S/C21H13IN2O3/c1-24-9-14(13-8-11(22)6-7-16(13)24)18-19(21(26)23-20(18)25)15-10-27-17-5-3-2-4-12(15)17/h2-10H,1H3,(H,23,25,26) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.07E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 4
(Homo sapiens (Human)) | BDBM50267607
![PNG](/data/jpeg/tenK5026/BindingDB_50267607.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK4/Cyclin D1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 5
(Homo sapiens (Human)) | BDBM50267607
![PNG](/data/jpeg/tenK5026/BindingDB_50267607.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.13E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK5/P35 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267606
![PNG](/data/jpeg/tenK5026/BindingDB_50267606.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(7-methoxyben...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2ccc(Br)cc12 |t:13| Show InChI InChI=1S/C22H15BrN2O4/c1-25-9-14(13-8-11(23)6-7-16(13)25)18-19(22(27)24-21(18)26)15-10-29-20-12(15)4-3-5-17(20)28-2/h3-10H,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 5
(Homo sapiens (Human)) | BDBM50267607
![PNG](/data/jpeg/tenK5026/BindingDB_50267607.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK5/P25 (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 3
(Homo sapiens (Human)) | BDBM50267607
![PNG](/data/jpeg/tenK5026/BindingDB_50267607.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB
KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.22E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK3/Cyclin E |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 9
(Homo sapiens (Human)) | BDBM50267607
![PNG](/data/jpeg/tenK5026/BindingDB_50267607.png) (3-(5-Bromo-1-methyl-1H-indol-3-yl)-4-(6-hydroxymet...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(Br)ccc12 |t:4| Show InChI InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.22E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK9/cyclin T1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267563
![PNG](/data/jpeg/tenK5026/BindingDB_50267563.png) (3-(6-Chloro-5-methoxy-1-methyl-1H-indol-3-yl)-4-(6...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(OCC4CC4)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C25H18ClFN2O4/c1-29-9-16(15-7-19(27)18(26)8-20(15)29)22-23(25(31)28-24(22)30)17-11-33-21-6-13(4-5-14(17)21)32-10-12-2-3-12/h4-9,11-12H,2-3,10H2,1H3,(H,28,30,31) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM2600
![PNG](/data/jpeg/tenK0/BindingDB_2600.png) ((Arylindolyl)maleimide deriv. 22 | 3-(1-benzofuran...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2ccccc12 |t:4| Show InChI InChI=1S/C21H14N2O3/c1-23-10-14(12-6-2-4-8-16(12)23)18-19(21(25)22-20(18)24)15-11-26-17-9-5-3-7-13(15)17/h2-11H,1H3,(H,22,24,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.41E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267642
![PNG](/data/jpeg/tenK5026/BindingDB_50267642.png) (3-(5-chloro-1-methyl-1H-indol-3-yl)-4-(5-fluoroben...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccc(F)cc23)c2cc(Cl)ccc12 |t:4| Show InChI InChI=1S/C21H12ClFN2O3/c1-25-8-14(12-6-10(22)2-4-16(12)25)18-19(21(27)24-20(18)26)15-9-28-17-5-3-11(23)7-13(15)17/h2-9H,1H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.84E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267760
![PNG](/data/jpeg/tenK5026/BindingDB_50267760.png) (3-Benzofuran-3-yl-4-(7-methoxymethyl-1-methyl-1H-i...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C23H18N2O4/c1-25-10-16(15-8-5-6-13(11-28-2)21(15)25)19-20(23(27)24-22(19)26)17-12-29-18-9-4-3-7-14(17)18/h3-10,12H,11H2,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267760
![PNG](/data/jpeg/tenK5026/BindingDB_50267760.png) (3-Benzofuran-3-yl-4-(7-methoxymethyl-1-methyl-1H-i...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C23H18N2O4/c1-25-10-16(15-8-5-6-13(11-28-2)21(15)25)19-20(23(27)24-22(19)26)17-12-29-18-9-4-3-7-14(17)18/h3-10,12H,11H2,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.09E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin A |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267564
![PNG](/data/jpeg/tenK5026/BindingDB_50267564.png) (3-(6-Chloro-5-methoxy-1-methyl-1H-indol-3-yl)-4-(6...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(OCC4CCC4)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C26H20ClFN2O4/c1-30-10-17(16-8-20(28)19(27)9-21(16)30)23-24(26(32)29-25(23)31)18-12-34-22-7-14(5-6-15(18)22)33-11-13-3-2-4-13/h5-10,12-13H,2-4,11H2,1H3,(H,29,31,32) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.09E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 9
(Homo sapiens (Human)) | BDBM50267523
![PNG](/data/jpeg/tenK5026/BindingDB_50267523.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(6-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 5.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK9/cyclin T1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Glycogen synthase kinase-3 beta
(Homo sapiens (Human)) | BDBM50267604
![PNG](/data/jpeg/tenK5026/BindingDB_50267604.png) (3-[6-(4-Chlorophenyl)-5-fluoro-1-methyl-1H-indol-3...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(c(F)cc12)-c1ccc(Cl)cc1 |t:13| Show InChI InChI=1S/C28H18ClFN2O4/c1-32-12-19(18-10-21(30)17(11-22(18)32)14-6-8-15(29)9-7-14)24-25(28(34)31-27(24)33)20-13-36-26-16(20)4-3-5-23(26)35-2/h3-13H,1-2H3,(H,31,33,34) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 7.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of human GSK3-beta by scintillation counting |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 6
(Homo sapiens (Human)) | BDBM50267760
![PNG](/data/jpeg/tenK5026/BindingDB_50267760.png) (3-Benzofuran-3-yl-4-(7-methoxymethyl-1-methyl-1H-i...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C23H18N2O4/c1-25-10-16(15-8-5-6-13(11-28-2)21(15)25)19-20(23(27)24-22(19)26)17-12-29-18-9-4-3-7-14(17)18/h3-10,12H,11H2,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 8.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK6/cyclin D3 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 1
(Homo sapiens (Human)) | BDBM50267760
![PNG](/data/jpeg/tenK5026/BindingDB_50267760.png) (3-Benzofuran-3-yl-4-(7-methoxymethyl-1-methyl-1H-i...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C23H18N2O4/c1-25-10-16(15-8-5-6-13(11-28-2)21(15)25)19-20(23(27)24-22(19)26)17-12-29-18-9-4-3-7-14(17)18/h3-10,12H,11H2,1-2H3,(H,24,26,27) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 8.53E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK1/Cyclin B |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 4
(Homo sapiens (Human)) | BDBM50267760
![PNG](/data/jpeg/tenK5026/BindingDB_50267760.png) (3-Benzofuran-3-yl-4-(7-methoxymethyl-1-methyl-1H-i...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C23H18N2O4/c1-25-10-16(15-8-5-6-13(11-28-2)21(15)25)19-20(23(27)24-22(19)26)17-12-29-18-9-4-3-7-14(17)18/h3-10,12H,11H2,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 8.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK4/Cyclin D1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
RAF proto-oncogene serine/threonine-protein kinase
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of cRAF |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267523
![PNG](/data/jpeg/tenK5026/BindingDB_50267523.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(6-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.06E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 6
(Homo sapiens (Human)) | BDBM50267523
![PNG](/data/jpeg/tenK5026/BindingDB_50267523.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(6-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.16E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK6/cyclin D3 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267523
![PNG](/data/jpeg/tenK5026/BindingDB_50267523.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(6-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.17E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 5
(Homo sapiens (Human)) | BDBM50267760
![PNG](/data/jpeg/tenK5026/BindingDB_50267760.png) (3-Benzofuran-3-yl-4-(7-methoxymethyl-1-methyl-1H-i...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C23H18N2O4/c1-25-10-16(15-8-5-6-13(11-28-2)21(15)25)19-20(23(27)24-22(19)26)17-12-29-18-9-4-3-7-14(17)18/h3-10,12H,11H2,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.27E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK5/P35 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 5
(Homo sapiens (Human)) | BDBM50267760
![PNG](/data/jpeg/tenK5026/BindingDB_50267760.png) (3-Benzofuran-3-yl-4-(7-methoxymethyl-1-methyl-1H-i...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C23H18N2O4/c1-25-10-16(15-8-5-6-13(11-28-2)21(15)25)19-20(23(27)24-22(19)26)17-12-29-18-9-4-3-7-14(17)18/h3-10,12H,11H2,1-2H3,(H,24,26,27) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.29E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK5/P25 (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 1
(Homo sapiens (Human)) | BDBM50267523
![PNG](/data/jpeg/tenK5026/BindingDB_50267523.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(6-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.34E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK1/Cyclin B |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 9
(Homo sapiens (Human)) | BDBM50267760
![PNG](/data/jpeg/tenK5026/BindingDB_50267760.png) (3-Benzofuran-3-yl-4-(7-methoxymethyl-1-methyl-1H-i...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C23H18N2O4/c1-25-10-16(15-8-5-6-13(11-28-2)21(15)25)19-20(23(27)24-22(19)26)17-12-29-18-9-4-3-7-14(17)18/h3-10,12H,11H2,1-2H3,(H,24,26,27) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK9/cyclin T1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 5
(Homo sapiens (Human)) | BDBM50267523
![PNG](/data/jpeg/tenK5026/BindingDB_50267523.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(6-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.61E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK5/P35 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 3
(Homo sapiens (Human)) | BDBM50267760
![PNG](/data/jpeg/tenK5026/BindingDB_50267760.png) (3-Benzofuran-3-yl-4-(7-methoxymethyl-1-methyl-1H-i...)Show SMILES COCc1cccc2c(cn(C)c12)C1=C(C(=O)NC1=O)c1coc2ccccc12 |t:15| Show InChI InChI=1S/C23H18N2O4/c1-25-10-16(15-8-5-6-13(11-28-2)21(15)25)19-20(23(27)24-22(19)26)17-12-29-18-9-4-3-7-14(17)18/h3-10,12H,11H2,1-2H3,(H,24,26,27) | PDB
KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.77E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK3/Cyclin E |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 4
(Homo sapiens (Human)) | BDBM50267523
![PNG](/data/jpeg/tenK5026/BindingDB_50267523.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(6-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.83E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK4/Cyclin D1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 5
(Homo sapiens (Human)) | BDBM50267523
![PNG](/data/jpeg/tenK5026/BindingDB_50267523.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(6-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.89E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK5/P25 (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 3
(Homo sapiens (Human)) | BDBM50267523
![PNG](/data/jpeg/tenK5026/BindingDB_50267523.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(6-...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(CO)ccc23)c2cc(F)c(Cl)cc12 |t:4| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29) | PDB
KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.51E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK3/Cyclin E |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267565
![PNG](/data/jpeg/tenK5026/BindingDB_50267565.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(7-...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-12(11-6-15(24)14(23)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.72E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin A |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 3
(Homo sapiens (Human)) | BDBM2579
![PNG](/data/jpeg/tenK0/BindingDB_2579.png) ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 2.74E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of ERK1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267679
![PNG](/data/jpeg/tenK5026/BindingDB_50267679.png) (3-(benzofuran-3-yl)-4-(5-cyclopropyl-1-methyl-1H-i...)Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3ccccc23)c2cc(ccc12)C1CC1 |t:4| Show InChI InChI=1S/C24H18N2O3/c1-26-11-17(16-10-14(13-6-7-13)8-9-19(16)26)21-22(24(28)25-23(21)27)18-12-29-20-5-3-2-4-15(18)20/h2-5,8-13H,6-7H2,1H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 1
(Homo sapiens (Human)) | BDBM50267565
![PNG](/data/jpeg/tenK5026/BindingDB_50267565.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(7-...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-12(11-6-15(24)14(23)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.62E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK1/Cyclin B |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase Chk1
(Homo sapiens (Human)) | BDBM50267521
![PNG](/data/jpeg/tenK5026/BindingDB_50267521.png) (3-(5-Fluoro-6-iodo-1-methyl-1H-indol-3-yl)-4-(7-me...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(I)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14FIN2O4/c1-26-8-12(11-6-14(23)15(24)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CHK1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 1
(Homo sapiens (Human)) | BDBM50267521
![PNG](/data/jpeg/tenK5026/BindingDB_50267521.png) (3-(5-Fluoro-6-iodo-1-methyl-1H-indol-3-yl)-4-(7-me...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(I)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14FIN2O4/c1-26-8-12(11-6-14(23)15(24)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK1/Cyclin B |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Inhibitor of nuclear factor kappa-B kinase subunit alpha
(Homo sapiens (Human)) | BDBM50267521
![PNG](/data/jpeg/tenK5026/BindingDB_50267521.png) (3-(5-Fluoro-6-iodo-1-methyl-1H-indol-3-yl)-4-(7-me...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(I)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14FIN2O4/c1-26-8-12(11-6-14(23)15(24)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of IKKalpha |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267521
![PNG](/data/jpeg/tenK5026/BindingDB_50267521.png) (3-(5-Fluoro-6-iodo-1-methyl-1H-indol-3-yl)-4-(7-me...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(I)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14FIN2O4/c1-26-8-12(11-6-14(23)15(24)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin A |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267521
![PNG](/data/jpeg/tenK5026/BindingDB_50267521.png) (3-(5-Fluoro-6-iodo-1-methyl-1H-indol-3-yl)-4-(7-me...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(I)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14FIN2O4/c1-26-8-12(11-6-14(23)15(24)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 4
(Homo sapiens (Human)) | BDBM50267565
![PNG](/data/jpeg/tenK5026/BindingDB_50267565.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(7-...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-12(11-6-15(24)14(23)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 5.95E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK4/Cyclin D1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 5
(Homo sapiens (Human)) | BDBM50267565
![PNG](/data/jpeg/tenK5026/BindingDB_50267565.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(7-...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-12(11-6-15(24)14(23)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 6.16E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK5/P35 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50267565
![PNG](/data/jpeg/tenK5026/BindingDB_50267565.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(7-...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-12(11-6-15(24)14(23)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 9.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK2/Cyclin E (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 3
(Homo sapiens (Human)) | BDBM50267565
![PNG](/data/jpeg/tenK5026/BindingDB_50267565.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(7-...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-12(11-6-15(24)14(23)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB
KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK3/Cyclin E |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 9
(Homo sapiens (Human)) | BDBM50267565
![PNG](/data/jpeg/tenK5026/BindingDB_50267565.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(7-...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-12(11-6-15(24)14(23)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK9/cyclin T1 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 5
(Homo sapiens (Human)) | BDBM50267565
![PNG](/data/jpeg/tenK5026/BindingDB_50267565.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(7-...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-12(11-6-15(24)14(23)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.08E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK5/P25 (unknown origin) |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |
Cyclin-dependent kinase 6
(Homo sapiens (Human)) | BDBM50267565
![PNG](/data/jpeg/tenK5026/BindingDB_50267565.png) (3-(6-Chloro-5-fluoro-1-methyl-1H-indol-3-yl)-4-(7-...)Show SMILES COc1cccc2c(coc12)C1=C(C(=O)NC1=O)c1cn(C)c2cc(Cl)c(F)cc12 |t:13| Show InChI InChI=1S/C22H14ClFN2O4/c1-26-8-12(11-6-15(24)14(23)7-16(11)26)18-19(22(28)25-21(18)27)13-9-30-20-10(13)4-3-5-17(20)29-2/h3-9H,1-2H3,(H,25,27,28) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.65E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of CDK6/cyclin D3 |
J Med Chem 52: 1853-63 (2009)
Article DOI: 10.1021/jm801317h BindingDB Entry DOI: 10.7270/Q24M94FZ |
More data for this Ligand-Target Pair | |