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SMILES: Clc1ccc(cc1Cl)-c1ncc(CC#N)n1-c1ccnc(NC2CCCN(C2)C(=O)C2CC2)n1

InChI Key: InChIKey=YHJXRSXZOCDBEA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 392735   
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
Mitogen-activated protein kinase 10


(Homo sapiens (Human))		BDBM392735
PNG
(Example 35 | US10301291, Compound 15e)
Show SMILES Clc1ccc(cc1Cl)-c1ncc(CC#N)n1-c1ccnc(NC2CCCN(C2)C(=O)C2CC2)n1
Show InChI InChI=1S/C24H23Cl2N7O/c25-19-6-5-16(12-20(19)26)22-29-13-18(7-9-27)33(22)21-8-10-28-24(31-21)30-17-2-1-11-32(14-17)23(34)15-3-4-15/h5-6,8,10,12-13,15,17H,1-4,7,11,14H2,(H,28,30,31)
PDB
MMDB

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US Patent
n/an/a 65n/an/an/an/an/an/a



Bristol-Myers Squibb Company



Assay Description
First of all, after a substrate was inserted into a prepared base reaction buffer solution (20 mM Hepes (pH 75), 10 mM MgCl2, 1 mM EGTA, 0.02% Brij35...

J Med Chem 52: 1994-2005 (2009)


BindingDB Entry DOI: 10.7270/Q20K2BW1
More data for this
Ligand-Target Pair