BDBM79803 2-[[2-[(1-cyclopentyl-6-hydroxy-4-keto-pyrimidin-2-yl)thio]acetyl]amino]benzoic acid methyl ester::2-[[2-[(1-cyclopentyl-6-hydroxy-4-oxo-2-pyrimidinyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester::MLS000056065::SMR000067168::cid_2079613::methyl 2-[2-(1-cyclopentyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanylethanoylamino]benzoate::methyl 2-[[2-(1-cyclopentyl-6-hydroxy-4-oxopyrimidin-2-yl)sulfanylacetyl]amino]benzoate

SMILES COC(=O)c1ccccc1NC(=O)CSc1nc(O)cc(=O)n1C1CCCC1

InChI Key InChIKey=AVKCHYMKYJVLNX-UHFFFAOYSA-N

Data  2 IC50

  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 2 hits for monomerid = 79803   

TargetOrexin/Hypocretin receptor type 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM79803(methyl 2-[2-(1-cyclopentyl-6-oxidanyl-4-oxidanylid...)
Affinity DataIC50: 137nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay
TargetOrexin/Hypocretin receptor type 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM79803(methyl 2-[2-(1-cyclopentyl-6-oxidanyl-4-oxidanylid...)
Affinity DataIC50: 4.86E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay