Reaction Details Report a problem with these data
Target
Cyclin-dependent kinase 4
Ligand
BDBM50192074
Substrate
n/a
Meas. Tech.
ChEMBL_404507 (CHEMBL910890)
IC50
3.6±n/a nM
Citation
Kawanishi, N; Sugimoto, T; Shibata, J; Nakamura, K; Masutani, K; Ikuta, M; Hirai, H Structure-based drug design of a highly potent CDK1,2,4,6 inhibitor with novel macrocyclic quinoxalin-2-one structure. Bioorg Med Chem Lett 16:5122-6 (2006) [PubMed] Article
More Info.:
Target
Name:
Cyclin-dependent kinase 4
Synonyms:
CDK4 | CDK4_HUMAN | Cell division protein kinase 4 | Cyclin-dependent kinase 4 (CDK 4) | PSK-J3
Type:
Enzyme Subunit
Mol. Mass.:
33731.96
Organism:
Homo sapiens (Human)
Description:
P11802
Residue:
303
Sequence:
MATSRYEPVAEIGVGAYGTVYKARDPHSGHFVALKSVRVPNGGGGGGGLPISTVREVALLRRLEAFEHPNVVRLMDVCATSRTDREIKVTLVFEHVDQDLRTYLDKAPPPGLPAETIKDLMRQFLRGLDFLHANCIVHRDLKPENILVTSGGTVKLADFGLARIYSYQMALTPVVVTLWYRAPEVLLQSTYATPVDMWSVGCIFAEMFRRKPLFCGNSEADQLGKIFDLIGLPPEDDWPRDVSLPRGAFPPRGPRPVQSVVPEMEESGAQLLLEMLTFNPHKRISAFRALQHSYLHKDEGNPE
Inhibitor
Name:
BDBM50192074
Synonyms:
22-hydroxy-15-oxa-8-thia-9,21,23-triazapentacyclo[14.6.2.1^{6,9}.0^{2,7}.0^{20,24}]pentacosa-1(23),2(7),3,5,16(24),17,19,21-octaen-25-one | CHEMBL386796
Type:
Small organic molecule
Emp. Form.:
C20H17N3O3S
Mol. Mass.:
379.432
SMILES:
O=c1n2CCCCCOc3cccc4[nH]c(=O)c(nc34)-c3cccc1c3s2