BDBM50620606 CHEMBL5431714

SMILES CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)C)c(O)c1

InChI Key InChIKey=PCXRACLQFPRCBB-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50620606   

TargetMu-type opioid receptor(Human)
Indiana University

Curated by ChEMBL
LigandPNGBDBM50620606(CHEMBL5431714)
Affinity DataIC50: 21nMAssay Description:Negative allosteric modulation of human mu opioid receptor expressed in HEK293 cells assessed as increase in cAMP accumulation in presence of fentany...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2024
Entry Details
PubMed
TargetAngiotensin-converting enzyme 2(Human)
Universidade Federal de Minas Gerais

Curated by ChEMBL
LigandPNGBDBM50620606(CHEMBL5431714)
Affinity DataIC50: 1.37E+3nMAssay Description:Inhibition of human ACE2 using Mca-APK(Dnp) as substrate incubated for 30 mins by fluorometer analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed