BDBM313808 US10167293, Example 1::[8-(phenylsulfonyl)-3,8-diazabicyclo[3.2.1]oct-3-yl](1H-1,2,3-triazol-4-yl)methanone

SMILES O=C(N1CC2CCC(C1)N2S(=O)(=O)c1ccccc1)c1c[nH]nn1

InChI Key InChIKey=YQYLTIJEONNPMZ-UHFFFAOYSA-N

Data  1 IC50

  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 1 hit for monomerid = 313808   

TargetAldo-keto reductase family 1 member C3(Human)
Bayer Pharma Aktiengesellschaft

US Patent
LigandChemical structure of BindingDB Monomer ID 313808BDBM313808(US10167293, Example 1 | [8-(phenylsulfonyl)-3,8-di...)
Affinity DataIC50: 3.70nMAssay Description:The enzyme used was recombinant human AKR1C3 (Aldo-keto reductase family 1 member C3; GenBank Accession No. NM_003739). This was expressed in E. coli...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/24/2019
Entry Details
US Patent