BDBM50279641 CHEMBL4175688

SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])c3cc(c(O)cc3CC[C@@]21[H])-c1ccncc1

InChI Key InChIKey=QUQRTYROXUUYJK-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 1 hit for monomerid = 50279641   

TargetCytochrome P450 1B1(Human)
Chu De Qu£Bec-Research Center

Curated by ChEMBL
LigandPNGBDBM50279641(CHEMBL4175688)
Affinity DataIC50: 120nMAssay Description:Inhibition of recombinant human CYP1B1 expressed in supersomes coexpressing P450 reductase using 7-ethyl-O-resorufin as substrate after 45 mins in pr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2020
Entry Details Article
PubMed