BDBM50485598 3R14S-OCHRATOXIN A::CHEBI:7719

SMILES C[C@@H]1Cc2c(cc(c(c2C(=O)O1)O)C(=O)N[C@@H](Cc3ccccc3)C(=O)O)Cl

InChI Key InChIKey=RWQKHEORZBHNRI-UHFFFAOYSA-N

Data  1 IC50

PDB links: 3 PDB IDs match 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 = 50485598   

TargetATP-binding cassette sub-family C member 2(Human)
Deutsches Krebsforschungszentrum

Curated by ChEMBL
LigandPNGBDBM50485598(CHEBI:7719 | 3R14S-OCHRATOXIN A)
Affinity DataIC50: 5.80E+4nMAssay Description:TP_TRANSPORTER: inhibition of PAH uptake (PAH: 0.1uM) in membrane vesicles from MRP2-expressing HEK cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2020
Entry Details Article
PubMed