Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Breakpoint cluster region protein [1-693]' and Ligand = 'BDBM111467'   

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
Breakpoint cluster region protein [1-693] (Homo sapiens (Human))	BDBM111467 (4-Methyl-3-(4-(pyridin-3-yl) pyrimidin-2-ylamino)-...) Show SMILES Cc1ccc(cc1Nc1nccc(n1)-c1cccnc1)C(=O)NCc1nccs1 Show InChI InChI=1S/C21H18N6OS/c1-14-4-5-15(20(28)25-13-19-23-9-10-29-19)11-18(14)27-21-24-8-6-17(26-21)16-3-2-7-22-12-16/h2-12H,13H2,1H3,(H,25,28)(H,24,26,27)	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
Xi'an Jiaotong University, No. 76, Yanta West Road, Xi'an, 710061, China					Assay Description ATP (6.021 μM) and substrate (457.7 nM) were used. Kinase, substrate peptide, and inhibitor were added in a 384-well plate. The reaction was s...				Chem Biol Drug Des 83: 592-9 (2014) Article DOI: 10.1111/cbdd.12272 BindingDB Entry DOI: 10.7270/Q2GX497N
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