Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase ABL1' and Ligand = 'BDBM120393'   

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))	BDBM120393 (US8703771, 6) Show SMILES Cc1ccc(NC(=O)c2ccc3C(CCc3c2)N2CCN(CCO)CC2)cc1Nc1nccc(n1)-c1cccnc1 Show InChI InChI=1S/C32H35N7O2/c1-22-4-7-26(20-29(22)37-32-34-12-10-28(36-32)25-3-2-11-33-21-25)35-31(41)24-5-8-27-23(19-24)6-9-30(27)39-15-13-38(14-16-39)17-18-40/h2-5,7-8,10-12,19-21,30,40H,6,9,13-18H2,1H3,(H,35,41)(H,34,36,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	7.5	28
Harbin Gloria Pharmaceuticals Co., Ltd. US Patent					Assay Description The activity of the compounds of this invention on Abl, c-Kit and PDGFR kinases was tested by Mobility Shift Assay (MSA). Kinase buffer: 62.5 mM HEPE...				US Patent US8703771 (2014) BindingDB Entry DOI: 10.7270/Q2CF9NS3
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