BDBM50020456 CHEMBL3290130

SMILES: Nc1cccc(Nc2ncc(NC(=O)c3cccc(c3)C(=O)Nc3cccc(c3)C(F)(F)F)cn2)c1

InChI Key: InChIKey=ZMVJOPIOBURPGU-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 = 50020456   

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
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM50020456 (CHEMBL3290130) Show SMILES Nc1cccc(Nc2ncc(NC(=O)c3cccc(c3)C(=O)Nc3cccc(c3)C(F)(F)F)cn2)c1 Show InChI InChI=1S/C25H19F3N6O2/c26-25(27,28)17-6-2-8-19(11-17)32-22(35)15-4-1-5-16(10-15)23(36)33-21-13-30-24(31-14-21)34-20-9-3-7-18(29)12-20/h1-14H,29H2,(H,32,35)(H,33,36)(H,30,31,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Inhibition of Btk (unknown origin) after 1 hr by HTRF assay				J Med Chem 57: 5112-28 (2014) Article DOI: 10.1021/jm4017762 BindingDB Entry DOI: 10.7270/Q2NK3GKX
					More data for this Ligand-Target Pair