BDBM174609 US9688676, 39 (R)-2-(3-(4-amino-2-oxo-3-(4-phenoxyphenyl)-2,3-dihydro-1H-imidazo[4,5-c]pyridin-1-yl)piperidine-1-carbonyl)-3-(1-oxidotetrahydro-2H-thiopyran-4-yl)acrylonitrile

SMILES: Nc1nccc2n([C@@H]3CCCN(C3)C(=O)C(=CC3CCS(=O)CC3)C#N)c(=O)n(-c3ccc(Oc4ccccc4)cc3)c12

InChI Key: InChIKey=YVMIXJGGCHMVHY-JRQBUODLSA-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 = 174609   

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))	BDBM174609 (US9688676, 39 (R)-2-(3-(4-amino-2-oxo-3-(4-phenoxy...) Show SMILES Nc1nccc2n([C@@H]3CCCN(C3)C(=O)C(=CC3CCS(=O)CC3)C#N)c(=O)n(-c3ccc(Oc4ccccc4)cc3)c12 |r,w:16.17| Show InChI InChI=1S/C32H32N6O4S/c33-20-23(19-22-13-17-43(41)18-14-22)31(39)36-16-4-5-25(21-36)37-28-12-15-35-30(34)29(28)38(32(37)40)24-8-10-27(11-9-24)42-26-6-2-1-3-7-26/h1-3,6-12,15,19,22,25H,4-5,13-14,16-18,21H2,(H2,34,35)/t22?,25-,43?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.30	n/a	n/a	n/a	n/a	n/a	25
PRINCIPIA BIOPHARMA INC. US Patent					Assay Description A Caliper-based kinase assay (Caliper Life Sciences, Hopkinton, Mass.) was used to measure inhibition of BTK kinase activity of a compound of the pre...				US Patent US9688676 (2017) BindingDB Entry DOI: 10.7270/Q2XD0ZVX
					More data for this Ligand-Target Pair