Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase Chk1' and Ligand = 'BDBM50334905'   

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
Serine/threonine-protein kinase Chk1 (Homo sapiens (Human))	BDBM50334905 (CHEMBL1643262 | ethyl 4-(3-(1-methyl-1H-pyrazol-4-...) Show SMILES CCOC(=O)c1ccc(Nc2cc(nc3c(cnn23)-c2cnn(C)c2)C2CCCNC2)cc1 Show InChI InChI=1S/C24H27N7O2/c1-3-33-24(32)16-6-8-19(9-7-16)28-22-11-21(17-5-4-10-25-12-17)29-23-20(14-27-31(22)23)18-13-26-30(2)15-18/h6-9,11,13-15,17,25,28H,3-5,10,12H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of recombinant His-CHK1 expressed in baculovirus after 2 hrs by scintillation proximity assay				Bioorg Med Chem Lett 21: 467-70 (2010) Article DOI: 10.1016/j.bmcl.2010.10.113 BindingDB Entry DOI: 10.7270/Q2J966MH
					More data for this Ligand-Target Pair