BDBM96990 (E)-3-(2-methoxyphenyl)-2-propenoic acid [2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] ester::(E)-3-(2-methoxyphenyl)acrylic acid [2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl] ester::MLS001018878::SMR000385349::[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] (E)-3-(2-methoxyphenyl)prop-2-enoate::[2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl] (E)-3-(2-methoxyphenyl)prop-2-enoate::cid_2086196

SMILES O=C1CCC(N2Cc3c(ccc4c3OC[C@@H]3CN(CC5CC6(CCN(c7ccc([C@H]8c9ccc(O)cc9OC[C@H]8c8ccccc8)cc7)CC6)C5)CCN43)C2=O)C(=O)N1

InChI Key InChIKey=LNHSBCBSVMTZCN-UHFFFAOYSA-N

Data  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 2 hits for monomerid = 96990   

TargetSteroid hormone receptor ERR1 LBD(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 96990BDBM96990(3-((S)-7-((7-(4-((3R,4S)-7-hydroxy-3- phenylchroma...)
Affinity DataIC50: 5nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/13/2026
Entry Details
US Patent

TargetDNA damage-binding protein 1/Protein cereblon(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 96990BDBM96990(3-((S)-7-((7-(4-((3R,4S)-7-hydroxy-3- phenylchroma...)
Affinity DataIC50: 50nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/13/2026
Entry Details
US Patent