Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Cyclin-dependent kinase/G2/mitotic-specific cyclin- 1 | ||
| Ligand | BDBM50378824 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1289044 (CHEMBL3118302) | ||
| IC50 | >100000±n/a nM | ||
| Citation |  Reddy, MV; Akula, B; Cosenza, SC; Athuluridivakar, S; Mallireddigari, MR; Pallela, VR; Billa, VK; Subbaiah, DR; Bharathi, EV; Vasquez-Del Carpio, R; Padgaonkar, A; Baker, SJ; Reddy, EP Discovery of 8-cyclopentyl-2-[4-(4-methyl-piperazin-1-yl)-phenylamino]-7-oxo-7,8-dihydro-pyrido[2,3-d]pyrimidine-6-carbonitrile (7x) as a potent inhibitor of cyclin-dependent kinase 4 (CDK4) and AMPK-related kinase 5 (ARK5). J Med Chem57:578-99 (2014) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Cyclin-dependent kinase/G2/mitotic-specific cyclin- 1 | |||
| Name: | Cyclin-dependent kinase/G2/mitotic-specific cyclin- 1 | ||
| Synonyms: | CDK1/B | CDK1/Cyclin B | CDK1/CyclinB | Cyclin B/Dependent Kinase 1 (CDK1) | Cyclin-Dependent Kinase 1 (CDK1) | Cyclin-dependent kinase 1/cyclin B1 | Cyclin-dependent kinase/G2/mitotic-specific cyclin 1 | cdk1 | ||
| Type: | Protein Complex | ||
| Mol. Mass.: | n/a | ||
| Description: | CDK1/Cyclin B complexes were purified from insect cells co-infected with baculovirus vectors containing each of the components. | ||
| Components: | This complex has 2 components. | ||
| Component 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: |
| ||
| Component 2 | |||
| Name: | G2/mitotic-specific cyclin-B1 | ||
| Synonyms: | CCNB | CCNB1 | CCNB1_HUMAN | ||
| Type: | Enzyme Subunit | ||
| Mol. Mass.: | 48340.95 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P14635 | ||
| Residue: | 433 | ||
| Sequence: |
| ||
| BDBM50378824 | |||
| n/a | |||
| Name | BDBM50378824 | ||
| Synonyms: | CHEMBL1242367 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C27H32N6O | ||
| Mol. Mass. | 456.5826 | ||
| SMILES | CCNc1cc(N[C@@H]2CC[C@H](O)CC2)nc(Nc2ccc3n(Cc4ccccc4)ccc3c2)n1 |r,wU:10.10,7.6,(34.48,6.65,;34.48,5.11,;33.15,4.34,;33.15,2.8,;34.49,2.03,;34.49,.48,;35.82,-.28,;35.83,-1.82,;34.49,-2.59,;34.49,-4.12,;35.81,-4.9,;35.81,-6.44,;37.15,-4.13,;37.15,-2.59,;33.16,-.28,;31.82,.48,;30.48,-.28,;29.15,.49,;27.83,-.28,;26.49,.48,;26.49,2.03,;25.36,3.06,;23.82,3.07,;23.05,4.4,;23.83,5.74,;23.06,7.07,;21.52,7.07,;20.75,5.74,;21.52,4.41,;25.99,4.47,;27.52,4.3,;27.83,2.79,;29.16,2.03,;31.82,2.03,)| | ||
| Structure | 
| ||