BDBM50576968 CHEMBL4871524

SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])[C@@H](CC2=CC(=O)CC[C@]12C)\C=C\C=C\C=C\[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@@]2([H])CC[C@]3(C)C(=O)CC[C@@]3([H])[C@]12[H]

InChI Key InChIKey=WQQGJRXOPNCMAT-WZLZEIGXSA-N

Data  1 IC50  1 Kd

  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 = 50576968   

TargetCytochrome P450 3A4(Human)
University of Quebec at Trois-Rivieres

Curated by ChEMBL
LigandPNGBDBM50576968(CHEMBL4871524)
Affinity DataIC50:  3.60E+3nMAssay Description:Inhibition of recombinant human CYP3A4 using BFC as substrateMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Human)
University of Quebec at Trois-Rivieres

Curated by ChEMBL
LigandPNGBDBM50576968(CHEMBL4871524)
Affinity DataKd:  1.40E+3nMAssay Description:Inhibition of human CYP3A4 assessed as dissociation constantMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed