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SMILES: OC1=CN(c2csc(c2Cl)-c2cccc(NC3CCCCC3)c2)S(=O)(=O)N1

InChI Key: InChIKey=YRUAOZHEEUFLPD-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50206988   
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 phosphatase non-receptor type 1


(Homo sapiens (Human))		BDBM50206988
PNG
(5-{4-chloro-5-[3-(cyclohexylamino)phenyl]thien-3-y...)
Show SMILES OC1=CN(c2csc(c2Cl)-c2cccc(NC3CCCCC3)c2)S(=O)(=O)N1 |t:1|
Show InChI InChI=1S/C18H20ClN3O3S2/c19-17-15(22-10-16(23)21-27(22,24)25)11-26-18(17)12-5-4-8-14(9-12)20-13-6-2-1-3-7-13/h4-5,8-11,13,20-21,23H,1-3,6-7H2
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Similars
Article
PubMed
 1.40E+4n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PTP1B assessed as pNPP hydrolysis

Bioorg Med Chem Lett 17: 2913-20 (2007)


Article DOI: 10.1016/j.bmcl.2007.02.043
BindingDB Entry DOI: 10.7270/Q29S1QPC
More data for this
Ligand-Target Pair