BDBM50567459 CHEMBL4857480

SMILES C(Oc1cnc(-c2ccc(cc2)-c2ccsc2)c(n1)-c1ccc(cc1)-c1ccsc1)C1CCNCC1

InChI Key InChIKey=GUZJVJMQJVBOIO-UHFFFAOYSA-N

Data  3 IC50

  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 3 hits for monomerid = 50567459   

TargetNonstructural protein 3(ZIKV)
Baylor College of Medicine

Curated by ChEMBL
LigandPNGBDBM50567459(CHEMBL4857480)
Affinity DataIC50: 1.40E+3nMAssay Description:Inhibition Zika virus NS3B (47 to 95 residues)/NS3 (1 to 170 residues) protease expressed in Escherichia coli BL21 using 7-amino-4-methylcoumarin as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed
TargetGenome polyprotein(DENV-2)
Baylor College of Medicine

Curated by ChEMBL
LigandPNGBDBM50567459(CHEMBL4857480)
Affinity DataIC50: 3.60E+3nMAssay Description:Inhibition Dengue serotype-2 NS3B/NS3 protease using 7-amino-4-methylcoumarin as substrate by fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed
TargetGenome polyprotein(WNV)
Baylor College of Medicine

Curated by ChEMBL
LigandPNGBDBM50567459(CHEMBL4857480)
Affinity DataIC50: 6.60E+3nMAssay Description:Inhibition West Nile virus NS3B/NS3 protease using 7-amino-4-methylcoumarin as substrate by fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed