Compile Data Set for Download or QSAR
Found 1 Enz. Inhib. hit(s) with Target = 'Cyclin-A2/Cyclin-dependent kinase 2' and Ligand = 'BDBM35664'
TargetCyclin-A2/Cyclin-dependent kinase 2(Homo sapiens (Human))
Vertex Pharmaceuticals Inc

LigandPNGBDBM35664(erk000628 | pyrimidylpyrrole, 11l)
Show SMILES Cc1cnc(Nc2cccc3OCCOc23)nc1-c1c[nH]c(c1)C(=O)N[C@H](CO)c1cccc(Cl)c1
Show InChI InChI=1S/C26H24ClN5O4/c1-15-12-29-26(31-19-6-3-7-22-24(19)36-9-8-35-22)32-23(15)17-11-20(28-13-17)25(34)30-21(14-33)16-4-2-5-18(27)10-16/h2-7,10-13,21,28,33H,8-9,14H2,1H3,(H,30,34)(H,29,31,32)/t21-/m1/s1
Affinity DataKi:  138nMAssay Description:A coupled spectrophotometric assay was used in which ADP generated by kinase was converted to ATP with the concomitant production of pyruvate from PE...More data for this Ligand-Target Pair