Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase Chk1' and Ligand = 'BDBM50204701'   

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))	BDBM50204701 ((1r,4r)-N-((3-(4-fluorophenyl)-1,4-dihydroindeno[1...) Show SMILES C[C@H]1CC[C@@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(F)cc2)c1 |wU:4.7,wD:1.0,(13.88,-1.68,;15.21,-.92,;16.54,-1.69,;17.88,-.93,;17.89,.6,;16.55,1.38,;15.22,.62,;19.22,1.37,;20.55,.6,;21.89,1.37,;21.89,2.91,;23.22,3.68,;24.55,2.92,;24.55,1.37,;26.03,.89,;26.94,2.14,;28.42,2.62,;28.42,4.18,;26.94,4.66,;26.03,3.4,;29.66,1.72,;29.5,.19,;30.74,-.72,;32.15,-.1,;33.39,-1,;32.31,1.44,;31.06,2.34,;23.22,.6,)| Show InChI InChI=1S/C24H26FN3/c1-15-2-9-20(10-3-15)26-14-16-4-11-21-18(12-16)13-22-23(27-28-24(21)22)17-5-7-19(25)8-6-17/h4-8,11-12,15,20,26H,2-3,9-10,13-14H2,1H3,(H,27,28)/t15-,20-	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	814	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of recombinant CHK1 assessed as human Cdc25C phosphorylation				Bioorg Med Chem 15: 2759-67 (2007) Article DOI: 10.1016/j.bmc.2007.01.012 BindingDB Entry DOI: 10.7270/Q2XS5V22
					More data for this Ligand-Target Pair