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SMILES: Nc1ccccc1SC(=N)C(C#N)c1cccc(c1)C(O)c1ccccn1

InChI Key: InChIKey=UXTBQSYWBXEGNG-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50141407   
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
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))		BDBM50141407
PNG
((Z)-3-Amino-3-(2-amino-phenylsulfanyl)-2-[3-(hydro...)
Show SMILES Nc1ccccc1SC(=N)C(C#N)c1cccc(c1)C(O)c1ccccn1
Show InChI InChI=1S/C21H18N4OS/c22-13-16(21(24)27-19-10-2-1-8-17(19)23)14-6-5-7-15(12-14)20(26)18-9-3-4-11-25-18/h1-12,16,20,24,26H,23H2
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Bristol-Myers Squibb Pharmaceuticals Research Institute

Curated by ChEMBL


Assay Description
Inhibitory potency against mitogen activated protein kinase kinase kinase 1

Bioorg Med Chem Lett 14: 1483-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.01.012
BindingDB Entry DOI: 10.7270/Q2H131F0
More data for this
Ligand-Target Pair