Reaction Details  Report a problem with these data
Target
Cyclin-dependent kinase 4
Ligand
BDBM112473
Substrate
n/a
Meas. Tech.
Kinase Assay
pH
7.4±n/a
IC50
4.4±n/a nM
Citation
 Chen, X; Dai, K; Duquette, J; Gribble, Jr., MW; Huard, JN; Keegan, KS; Li, Z; Lively, SE; McGee, LR; Ragains, ML; Wang, X; Weidner, MF; Zhang, J Fused tricyclic dual inhibitors of CDK 4/6 and FLT3 US Patent  US8623885 Publication Date 1/7/2014
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:
BDBM112473
Synonyms:
US8623885, 14
Type:
Small organic molecule
Emp. Form.:
C27H31N7O
Mol. Mass.:
469.5813
SMILES:
C[C@H]1CC[C@@H](CC1)n1c2cnccc2c2cnc(Nc3ccc4CN(CC(C)c4n3)C(C)=O)nc12 |r,w:26.28,wU:4.7,wD:1.0,(4.8,-3.21,;4.4,-1.73,;5.49,-.64,;5.09,.85,;3.6,1.25,;2.51,.16,;2.91,-1.33,;3.2,2.74,;4.11,3.98,;5.64,4.14,;6.26,5.55,;5.36,6.8,;3.83,6.64,;3.2,5.23,;1.74,4.75,;.4,5.52,;-.93,4.75,;-.93,3.21,;-2.26,2.44,;-2.26,.9,;-.93,.13,;-.93,-1.41,;-2.26,-2.18,;-2.26,-3.72,;-3.6,-4.49,;-4.93,-3.72,;-4.93,-2.18,;-6.26,-1.41,;-3.6,-1.41,;-3.6,.13,;-3.6,-6.03,;-2.26,-6.8,;-4.93,-6.8,;.4,2.44,;1.74,3.21,)|
Structure:
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