Reaction Details Report a problem with these data
Target
Cyclin-dependent kinase 6
Ligand
BDBM132288
Substrate
n/a
Meas. Tech.
In Vitro Assay
pH
7.4±n/a
Temperature
310.15±n/a K
IC50
5.9±n/a nM
Citation
 Connors, RV; Kang, D; Eksterowicz, J; Fan, P; Fisher, B; Fu, J; Li, K; Li, Z; McGee, LR; Sharma, R; Wang, X; McMinn, DL; Mihalic, JT; Deignan, J Fused pyridine, pyrimidine and triazine compounds as cell cycle inhibitors US Patent  US8841312 Publication Date 9/23/2014 
Target
Name:
Cyclin-dependent kinase 6
Synonyms:
CDK6 | CDK6_HUMAN | CDKN6 | Cell division protein kinase 6 | Cyclin-dependent kinase 6 (CDK 6) | Serine/threonine-protein kinase PLSTIRE
Type:
Enzyme Subunit
Mol. Mass.:
36937.42
Organism:
Homo sapiens (Human)
Description:
Q00534
Residue:
326
Sequence:
MEKDGLCRADQQYECVAEIGEGAYGKVFKARDLKNGGRFVALKRVRVQTGEEGMPLSTIREVAVLRHLETFEHPNVVRLFDVCTVSRTDRETKLTLVFEHVDQDLTTYLDKVPEPGVPTETIKDMMFQLLRGLDFLHSHRVVHRDLKPQNILVTSSGQIKLADFGLARIYSFQMALTSVVVTLWYRAPEVLLQSSYATPVDLWSVGCIFAEMFRRKPLFRGSSDVDQLGKILDVIGLPGEEDWPRDVALPRQAFHSKSAQPIEKFVTDIDELGKDLLLKCLTFNPAKRISAYSALSHPYFQDLERCKENLDSHLPPSQNTSELNTA
  
Inhibitor
Name:
BDBM132288
Synonyms:
US8841312, 31
Type:
Small organic molecule
Emp. Form.:
C24H28N8O
Mol. Mass.:
444.5321
SMILES:
O[C@H]1CCC(CC1)n1c2cnccc2c2cnc(Nc3ccc(cn3)N3CCNCC3)nc12 |r,wD:1.0,(4.94,-2.6,;4.17,-1.26,;4.94,.07,;4.17,1.4,;2.63,1.4,;1.86,.07,;2.63,-1.26,;1.86,2.74,;2.76,3.98,;4.3,4.14,;4.92,5.55,;4.02,6.8,;2.49,6.64,;1.86,5.23,;.39,4.75,;-.94,5.52,;-2.27,4.75,;-2.27,3.21,;-3.61,2.44,;-3.61,.9,;-2.27,.13,;-2.27,-1.41,;-3.61,-2.18,;-4.94,-1.41,;-4.94,.13,;-3.61,-3.72,;-4.94,-4.49,;-4.94,-6.03,;-3.61,-6.8,;-2.27,-6.03,;-2.27,-4.49,;-.94,2.44,;.39,3.21,)|
Structure:
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