BDBM72171 (5Z)-2-amino-5-[(1-benzylindol-3-yl)methylene]-2-thiazolin-4-one::(5Z)-2-amino-5-[(1-benzylindol-3-yl)methylidene]-1,3-thiazol-4-one::(5Z)-2-amino-5-[[1-(phenylmethyl)-3-indolyl]methylidene]-4-thiazolone::(5Z)-2-azanyl-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-1,3-thiazol-4-one::5-(1-Benzyl-1H-indol-3-ylmethylene)-2-imino-thiazolidin-4-one::MLS000564009::SMR000177653::cid_5766715

SMILES NC1=NC(=O)C(S1)=Cc1cn(Cc2ccccc2)c2ccccc12

InChI Key InChIKey=VACBJTYDCQEWTI-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 = 72171   

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 72171BDBM72171(US20250368624, Compound CQ113)
Affinity DataIC50: 560nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...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 72171BDBM72171(US20250368624, Compound CQ113)
Affinity DataIC50: 2.90E+3nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/15/2026
Entry Details US Patent