BDBM50639275 CHEMBL1598041

SMILES Cc1ccc(cc1)C2(CCCC2)c3nc(on3)CN(C)Cc4cnn(c4)C

InChI Key InChIKey=PYOPUXIDJFMOTI-UHFFFAOYSA-N

PDB links: 1 PDB ID matches this monomer.

  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 1 hit for monomerid = 50639275   

TargetRetinol-binding protein 1(Homo sapiens)
Sichuan University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50639275BDBM50639275(CHEMBL1598041)
Affinity DataKi:  7.10E+3nMAssay Description:Binding affinity to CRBP1 (unknown origin) assessed as inhibition constantMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)