BDBM50422419 CHEMBL4168004

SMILES c1cc(cc2c1ccc(n2)C(=O)c3ccc(c(c3)O)F)C#N

InChI Key InChIKey=LDOZUOMHDNDABQ-UHFFFAOYSA-N

Data  1 KI

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 = 50422419   

Target17-beta-hydroxysteroid dehydrogenase 14(Human)
Philipps University Marburg

Curated by ChEMBL
LigandPNGBDBM50422419(CHEMBL4168004)
Affinity DataKi:  9nMAssay Description:Binding affinity to recombinant 17beta-HSD14 (unknown origin) expressed in Escherichia coli BL21 pLysS strain using E2 as substrate in presence of NA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2020
Entry Details Article
PubMedPDB3D3D Structure (crystal)