Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase ABL1' and Ligand = 'BDBM50358832'   

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
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50358832 (CHEMBL1923082) Show SMILES CSc1cccc(c1)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1 Show InChI InChI=1S/C24H21N5OS/c1-16-8-9-19(27-23(30)17-5-3-7-20(13-17)31-2)14-22(16)29-24-26-12-10-21(28-24)18-6-4-11-25-15-18/h3-15H,1-2H3,(H,27,30)(H,26,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Beijing National Laboratory for Molecular Sciences Curated by ChEMBL					Assay Description Inhibition of Abl using DAIpYAAPFAKKK phosphopeptide as substrate by MALDI-MS analysis				Bioorg Med Chem Lett 21: 6964-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.127 BindingDB Entry DOI: 10.7270/Q289168N
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