BDBM72134 2-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester::2-[[2-(1,3-benzoxazol-2-ylthio)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester::MLS000582293::SMR000200832::cid_1248388::ethyl 2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate::ethyl 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate::ethyl 2-{[(1,3-benzoxazol-2-ylthio)acetyl]amino}-4,5-dimethyl-3-thiophenecarboxylate

SMILES CCOC(=O)c1c(C)c(C)sc1NC(=O)CSc1nc2ccccc2o1

InChI Key InChIKey=YHODVFOHXCICBZ-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 72134   

TargetXaa-Pro dipeptidase(Human)
Memorial Sloan-Kettering Cancer Center; Memorial Hospital for Cancer and Allied Diseases; Sloan-Kettering Institute for Cancer Research

US Patent
LigandChemical structure of BindingDB Monomer ID 72134BDBM72134(US20250368624, Compound CQ75)
Affinity DataIC50: 300nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/15/2026
Entry Details US Patent

TargetXaa-Pro aminopeptidase 1(Human)
Memorial Sloan-Kettering Cancer Center; Memorial Hospital for Cancer and Allied Diseases; Sloan-Kettering Institute for Cancer Research

US Patent
LigandChemical structure of BindingDB Monomer ID 72134BDBM72134(US20250368624, Compound CQ75)
Affinity DataIC50: 1.15E+5nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/15/2026
Entry Details US Patent