Reaction Details | |||
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Target | Cyclin-dependent kinase 1 | ||
Ligand | BDBM50132192 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEBML_52680 | ||
IC50 | 30±n/a nM | ||
Citation | Moravec, J; Krystof, V; Hanus, J; Havlícek, L; Moravcová, D; Fuksová, K; Kuzma, M; Lenobel, R; Otyepka, M; Strnad, M 2,6,8,9-tetrasubstituted purines as new CDK1 inhibitors. Bioorg Med Chem Lett13:2993-6 (2003) [PubMed] | ||
More Info.: | Get all data from this article, Assay Method | ||
Cyclin-dependent kinase 1 | |||
Name: | Cyclin-dependent kinase 1 | ||
Synonyms: | CDC2 | CDC28A | CDK1 | CDK1_HUMAN | CDKN1 | Cell division control protein 2 homolog | Cell division protein kinase 1 | Cyclin-dependent kinase 1 (CDK1) | P34CDC2 | p34 protein kinase | ||
Type: | Enzyme Subunit | ||
Mol. Mass.: | 34101.08 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P06493 | ||
Residue: | 297 | ||
Sequence: |
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BDBM50132192 | |||
n/a | |||
Name | BDBM50132192 | ||
Synonyms: | CHEMBL102871 | N*2*-(4-Amino-cyclohexyl)-N*6*-(3-chloro-phenyl)-9-isopropyl-9H-purine-2,6-diamine | ||
Type | Small organic molecule | ||
Emp. Form. | C20H26ClN7 | ||
Mol. Mass. | 399.92 | ||
SMILES | CC(C)n1cnc2c(Nc3cccc(Cl)c3)nc(NC3CCC(N)CC3)nc12 |(1.38,-4.56,;2.41,-3.41,;3.9,-3.73,;1.92,-1.94,;2.85,-.68,;1.92,.56,;.45,.09,;-.88,.86,;-.89,2.4,;.45,3.15,;1.77,2.4,;3.11,3.17,;3.11,4.71,;1.77,5.48,;1.76,7.02,;.43,4.68,;-2.21,.07,;-2.21,-1.47,;-3.56,-2.24,;-4.88,-1.47,;-4.88,.09,;-6.2,.86,;-7.55,.09,;-8.88,.86,;-7.55,-1.45,;-6.22,-2.22,;-.88,-2.24,;.45,-1.47,)| | ||
Structure |