BDBM45517 MLS000551058::N'-[2-(benzylamino)-2-keto-ethyl]-N'-(2-thenyl)-N-thiazol-2-yl-succinamide::N'-[2-(benzylamino)-2-oxoethyl]-N-(1,3-thiazol-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide::N'-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-N-(1,3-thiazol-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide::N'-[2-oxo-2-[(phenylmethyl)amino]ethyl]-N-(2-thiazolyl)-N'-(thiophen-2-ylmethyl)butanediamide::N-(Benzylcarbamoyl-methyl)-N'-thiazol-2-yl-N-thiophen-2-ylmethyl-succinamide::SMR000173089::cid_3205311

SMILES O=C(CCC(=O)N(CC(=O)NCc1ccccc1)Cc1cccs1)Nc1nccs1

InChI Key InChIKey=ZPVRVGRPRCCHFM-UHFFFAOYSA-N

Data  2 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 45517   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM45517(N'-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay
TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM45517(N'-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/8/2011
Entry Details
PCBioAssay
TargetGlycogen synthase kinase-3 beta(Human)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM45517(N'-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-...)
Affinity DataEC50: >3.00E+5nMAssay Description:Keywords: GSK3beta, dose response, kinase, inhibition, HTS Assay Overview: The glycogen synthase kinase-3 beta (GSK-3b) is a known master regulator f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/29/2011
Entry Details
PCBioAssay