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SMILES: CCOC(=O)N1CCC[C@H](C1)c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12

InChI Key: InChIKey=MVDHWBGXVDBULI-LJQANCHMSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 267517   
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))		BDBM267517
PNG
((R)-4-(8-amino-3-(1-propionylpiperidin-3-yl) imida...)
Show SMILES CCOC(=O)N1CCC[C@H](C1)c1nc(-c2ccc(cc2)C(=O)Nc2ccccn2)c2c(N)nccn12 |r|
Show InChI InChI=1S/C26H27N7O3/c1-2-36-26(35)32-14-5-6-19(16-32)24-31-21(22-23(27)29-13-15-33(22)24)17-8-10-18(11-9-17)25(34)30-20-7-3-4-12-28-20/h3-4,7-13,15,19H,2,5-6,14,16H2,1H3,(H2,27,29)(H,28,30,34)/t19-/m1/s1
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US Patent
n/an/an/an/a<10n/an/a7.225



MERCK SHARP & DOHME CORP.; MERCK SHARP & DOHME B.V.

US Patent


Assay Description
Btk enzyme activity is measured using the IMAP (immobilized metal ion affinity-based fluorescence polarization) assay as outlined below. Btk enzyme (...

US Patent US9718828 (2017)


BindingDB Entry DOI: 10.7270/Q2H9977T
More data for this
Ligand-Target Pair