BDBM50312202 4-((6-(3-(3-(3-(trifluoromethyl)phenyl)ureido)phenyl)imidazo[1,2-a]pyrazin-8-ylamino)methyl)benzoic acid::CHEMBL1081062

SMILES: OC(=O)c1ccc(CNc2nc(cn3ccnc23)-c2cccc(NC(=O)Nc3cccc(c3)C(F)(F)F)c2)cc1

InChI Key: InChIKey=KOMBODFBKQOZRA-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 = 50312202   

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
Ephrin type-B receptor 4 (Homo sapiens (Human))	BDBM50312202 (4-((6-(3-(3-(3-(trifluoromethyl)phenyl)ureido)phen...) Show SMILES OC(=O)c1ccc(CNc2nc(cn3ccnc23)-c2cccc(NC(=O)Nc3cccc(c3)C(F)(F)F)c2)cc1 Show InChI InChI=1S/C28H21F3N6O3/c29-28(30,31)20-4-2-6-22(14-20)35-27(40)34-21-5-1-3-19(13-21)23-16-37-12-11-32-25(37)24(36-23)33-15-17-7-9-18(10-8-17)26(38)39/h1-14,16H,15H2,(H,33,36)(H,38,39)(H2,34,35,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
CGI Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibition of EphB4 autophosphorylation by cell based assay				Bioorg Med Chem Lett 19: 6991-5 (2009) Article DOI: 10.1016/j.bmcl.2009.10.037 BindingDB Entry DOI: 10.7270/Q2DR2VM3
					More data for this Ligand-Target Pair