Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 2/G1/S-specific cyclin-E1' and Ligand = 'BDBM5601'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1 (Homo sapiens (Human))	BDBM5601 (3-(4-n-Butylphenyl)-5-(acetamido)indeno[1,2-c]pyra...) Show SMILES CCCCc1ccc(cc1)-c1[nH]nc2-c3cccc(NC(C)=O)c3C(=O)c12 Show InChI InChI=1S/C22H21N3O2/c1-3-4-6-14-9-11-15(12-10-14)20-19-21(25-24-20)16-7-5-8-17(23-13(2)26)18(16)22(19)27/h5,7-12H,3-4,6H2,1-2H3,(H,23,26)(H,24,25)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>560	n/a	n/a	n/a	n/a	7.6	22
Bristol-Myers Squibb Company					Assay Description The enzyme was assayed with substrate GST-Rb in the presence of 50 uM ATP/[gamma-32P] ATP, and capturing the 32-P labeled reaction products on GSH-Se...				J Med Chem 45: 5233-48 (2002) Article DOI: 10.1021/jm0201722 BindingDB Entry DOI: 10.7270/Q2MG7MQJ
					More data for this Ligand-Target Pair