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SMILES: Fc1ccc(cc1C(F)(F)F)-c1ncc(CC#N)n1-c1ccnc(NC2CCCN(C2)C(=O)C2CC2)n1

InChI Key: InChIKey=AMJPALGZWXBOKQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 392736   
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))		BDBM392736
PNG
(Example 36 | US10301291, Compound 15f)
Show SMILES Fc1ccc(cc1C(F)(F)F)-c1ncc(CC#N)n1-c1ccnc(NC2CCCN(C2)C(=O)C2CC2)n1
Show InChI InChI=1S/C25H23F4N7O/c26-20-6-5-16(12-19(20)25(27,28)29)22-32-13-18(7-9-30)36(22)21-8-10-31-24(34-21)33-17-2-1-11-35(14-17)23(37)15-3-4-15/h5-6,8,10,12-13,15,17H,1-4,7,11,14H2,(H,31,33,34)
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