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SMILES: CN(CCNC(=O)C=C)c1cccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(c2CO)-n2ncc3c4CCCCc4sc3c2=O)n1

InChI Key: InChIKey=HXFQXEOUVCXFBT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 206360   
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))		BDBM206360
PNG
(US9260415, 111)
Show SMILES CN(CCNC(=O)C=C)c1cccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(c2CO)-n2ncc3c4CCCCc4sc3c2=O)n1
Show InChI InChI=1S/C34H34FN7O4S/c1-4-31(44)36-12-13-40(2)30-11-7-10-29(39-30)38-26-14-20(18-41(3)33(26)45)23-15-21(35)16-27(25(23)19-43)42-34(46)32-24(17-37-42)22-8-5-6-9-28(22)47-32/h4,7,10-11,14-18,43H,1,5-6,8-9,12-13,19H2,2-3H3,(H,36,44)(H,38,39)
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US Patent
 0.494n/an/an/an/an/an/a7.5n/a



Genentech, Inc.

US Patent


Assay Description
A generalized procedure for a standard biochemical Btk, Kinase Assay that can be used to test Formula I compounds is as follows. A master mix minus B...

US Patent US9260415 (2016)


BindingDB Entry DOI: 10.7270/Q2WH2NT7
More data for this
Ligand-Target Pair