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SMILES: Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C(=O)Nc1cnc(Nc2cccc(NS(=O)(=O)C=C)c2)nc1

InChI Key: InChIKey=VFCFJDLIWVJPMO-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50020486   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Tyrosine-protein kinase BTK


(Homo sapiens (Human))		BDBM50020486
PNG
(CHEMBL3290145)
Show SMILES Cc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C(=O)Nc1cnc(Nc2cccc(NS(=O)(=O)C=C)c2)nc1
Show InChI InChI=1S/C28H23F3N6O4S/c1-3-42(40,41)37-22-9-5-8-20(13-22)36-27-32-15-23(16-33-27)35-26(39)24-14-21(11-10-17(24)2)34-25(38)18-6-4-7-19(12-18)28(29,30)31/h3-16,37H,1H2,2H3,(H,34,38)(H,35,39)(H,32,33,36)
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Similars
Article
PubMed
n/an/a 16n/an/an/an/an/an/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