BDBM111463 4-Methyl-N-(pyridin-3-yl)-3-(4-(pyridin-3-yl) pyrimidin-2-ylamino) benzamide (A16)

SMILES: Cc1ccc(cc1Nc1nccc(n1)-c1cccnc1)C(=O)NCc1cccnc1

InChI Key: InChIKey=AUPAMTCBUJMBCY-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 111463   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Bcr-Abl (Homo sapiens (Human))	BDBM111463 (4-Methyl-N-(pyridin-3-yl)-3-(4-(pyridin-3-yl) pyri...) Show SMILES Cc1ccc(cc1Nc1nccc(n1)-c1cccnc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C23H20N6O/c1-16-6-7-18(22(30)27-14-17-4-2-9-24-13-17)12-21(16)29-23-26-11-8-20(28-23)19-5-3-10-25-15-19/h2-13,15H,14H2,1H3,(H,27,30)(H,26,28,29)	PDB MMDB Reactome pathway B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.03E+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
					More data for this Ligand-Target Pair