BDBM50236041 CHEMBL4093840

SMILES: CCC(=O)Nc1cc(Nc2ncc(C(=O)Nc3cc(NC(=O)c4cccc(c4)C(F)(F)F)ccc3C)c(NC)n2)ccc1C

InChI Key: InChIKey=BYCFKWQXKQNWSN-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 = 50236041   

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
Cytoplasmic tyrosine-protein kinase BMX (Homo sapiens (Human))	BDBM50236041 (CHEMBL4093840) Show SMILES CCC(=O)Nc1cc(Nc2ncc(C(=O)Nc3cc(NC(=O)c4cccc(c4)C(F)(F)F)ccc3C)c(NC)n2)ccc1C Show InChI InChI=1S/C31H30F3N7O3/c1-5-26(42)39-24-15-22(12-10-17(24)2)38-30-36-16-23(27(35-4)41-30)29(44)40-25-14-21(11-9-18(25)3)37-28(43)19-7-6-8-20(13-19)31(32,33)34/h6-16H,5H2,1-4H3,(H,37,43)(H,39,42)(H,40,44)(H2,35,36,38,41)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	102	n/a	n/a	n/a	n/a	n/a	n/a
High Magnetic Field Laboratory Curated by ChEMBL					Assay Description Inhibition of full-length recombinant human His-tagged BMX expressed in baculovirus expression system using Poly(4:1 Glu, Tyr) as substrate after 1 h...				J Med Chem 60: 1793-1816 (2017) Article DOI: 10.1021/acs.jmedchem.6b01413 BindingDB Entry DOI: 10.7270/Q2GH9M74
					More data for this Ligand-Target Pair