Reaction Details | |||
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Target | Serine/threonine-protein kinase Chk1 | ||
Ligand | BDBM50204713 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_442099 (CHEMBL891237) | ||
IC50 | 8742±n/a nM | ||
Citation | Tong, Y; Claiborne, A; Stewart, KD; Park, C; Kovar, P; Chen, Z; Credo, RB; Gu, WZ; Gwaltney, SL; Judge, RA; Zhang, H; Rosenberg, SH; Sham, HL; Sowin, TJ; Lin, NH Discovery of 1,4-dihydroindeno[1,2-c]pyrazoles as a novel class of potent and selective checkpoint kinase 1 inhibitors. Bioorg Med Chem15:2759-67 (2007) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Serine/threonine-protein kinase Chk1 | |||
Name: | Serine/threonine-protein kinase Chk1 | ||
Synonyms: | CHEK1 | CHK1 | CHK1 checkpoint homolog | CHK1_HUMAN | Checkpoint kinase-1 (CHK1) | ||
Type: | Enzyme Catalytic Domain | ||
Mol. Mass.: | 54443.02 | ||
Organism: | Homo sapiens (Human) | ||
Description: | gi_166295192 | ||
Residue: | 476 | ||
Sequence: |
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BDBM50204713 | |||
n/a | |||
Name | BDBM50204713 | ||
Synonyms: | CHEMBL390627 | N-(2-hydroxyethyl)-4-(6-(((1r,4r)-4-methylcyclohexylamino)methyl)-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)benzenesulfonamide | ||
Type | Small organic molecule | ||
Emp. Form. | C26H32N4O3S | ||
Mol. Mass. | 480.622 | ||
SMILES | C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c-2n[nH]c3-c2ccc(cc2)S(=O)(=O)NCCO)c1 |wU:4.7,wD:1.0,(16.56,-3.78,;17.89,-3.01,;19.22,-3.78,;20.56,-3.02,;20.57,-1.49,;19.22,-.72,;17.9,-1.48,;21.9,-.72,;23.23,-1.49,;24.56,-.72,;24.56,.82,;25.89,1.59,;27.23,.83,;27.23,-.73,;28.7,-1.2,;29.61,.04,;28.7,1.31,;29.61,2.56,;31.1,2.08,;31.09,.53,;32.33,-.38,;32.17,-1.91,;33.41,-2.82,;34.82,-2.19,;34.98,-.65,;33.73,.24,;36.06,-3.09,;35.16,-4.34,;36.97,-1.85,;37.3,-4,;38.71,-3.37,;39.95,-4.28,;41.36,-3.65,;25.89,-1.5,)| | ||
Structure |