BDBM246407 US9446130, 25

SMILES: CC(C)Oc1ccnc(NC(=O)c2ccc(cc2)-c2nc(N3CCn4c(C3)nnc4C(F)(F)F)n3ccnc(N)c23)c1

InChI Key: InChIKey=PBOGXWOJLHDIPM-UHFFFAOYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 246407   

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))	BDBM246407 (US9446130, 25) Show SMILES CC(C)Oc1ccnc(NC(=O)c2ccc(cc2)-c2nc(N3CCn4c(C3)nnc4C(F)(F)F)n3ccnc(N)c23)c1 Show InChI InChI=1S/C27H25F3N10O2/c1-15(2)42-18-7-8-32-19(13-18)34-24(41)17-5-3-16(4-6-17)21-22-23(31)33-9-10-40(22)26(35-21)38-11-12-39-20(14-38)36-37-25(39)27(28,29)30/h3-10,13,15H,11-12,14H2,1-2H3,(H2,31,33)(H,32,34,41)	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	43	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Assay Method B: BTK enzymatic activity was determined with the LANCE (Lanthanide Chelate Excite) TR-FRET (Time-resolved fluorescence resonance energy...				US Patent US9446130 (2016) BindingDB Entry DOI: 10.7270/Q22806H6
					More data for this Ligand-Target Pair