BDBM50595279 CHEMBL5187952

SMILES Oc1ccc(cc1CC=C)-c1cc(CC=C)cc(CSc2nnc(o2)-c2cccnc2)c1O

InChI Key InChIKey=KMWDKBAKCDLVGL-UHFFFAOYSA-N

Data  2 Kd

  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 = 50595279   

TargetSpike glycoprotein(2019-nCoV)
Zhengzhou University

Curated by ChEMBL
LigandPNGBDBM50595279(CHEMBL5187952)
Affinity DataKd:  7.29E+3nMAssay Description:Binding affinity to SARS-CoV-2 spike protein receptor-binding domain assessed as equilibrium dissociation constant by biolayer interferometry assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetAngiotensin-converting enzyme 2(Human)
Zhengzhou University

Curated by ChEMBL
LigandPNGBDBM50595279(CHEMBL5187952)
Affinity DataKd:  1.60E+4nMAssay Description:Binding affinity to human ACE2 assessed as equilibrium dissociation constant by biolayer interferometry assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed