BDBM50444549 CHEMBL3099695

SMILES Fc1cc(ccc1[C@H]1CCc2cncn12)C#N

InChI Key InChIKey=USUZGMWDZDXMDG-CYBMUJFWSA-N

Data  30 IC50

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 2 hits for monomerid = 50444549   

TargetAromatase(Homo sapiens (Human))
Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50444549(CHEMBL3099695)
Affinity DataIC50:  1.59E+3nMAssay Description:Inhibition of CYP19A1 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSteroid 17-alpha-hydroxylase/17,20 lyase(Homo sapiens (Human))
Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50444549(CHEMBL3099695)
Affinity DataIC50:  3.98E+3nMAssay Description:Inhibition of CYP17A1 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed