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SMILES: CN1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(s4)-c4cn[nH]c4)c3)sc2C1

InChI Key: InChIKey=UOMWJXFLQYIMLU-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 119958   
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
Rho-associated protein kinase 2


(Homo sapiens (Human))		BDBM119958
PNG
(US8697911, 120)
Show SMILES CN1CCc2nc(NC(=O)c3cccc(CNC(=O)c4ccc(s4)-c4cn[nH]c4)c3)sc2C1
Show InChI InChI=1S/C23H22N6O2S2/c1-29-8-7-17-20(13-29)33-23(27-17)28-21(30)15-4-2-3-14(9-15)10-24-22(31)19-6-5-18(32-19)16-11-25-26-12-16/h2-6,9,11-12H,7-8,10,13H2,1H3,(H,24,31)(H,25,26)(H,27,28,30)
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KEGG

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PC cid
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Similars
US Patent
n/an/a 0.770n/an/an/an/a7.2n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
This assay is performed using FAM S6 substrate peptide (Catalogue #R7184) and IMAP FP Screening Express Kit detection reagents from Molecular Devices...

US Patent US8697911 (2014)


BindingDB Entry DOI: 10.7270/Q25X27KR
More data for this
Ligand-Target Pair