BDBM50628591 GKT-137831::GKT-831::SETANAXIB::Setanaxib

SMILES CN(C)c1cccc(c1)-c1n(C)c(=O)cc2[nH]n(-c3ccccc3Cl)c(=O)c12

InChI Key InChIKey=RGYQPQARIQKJKH-UHFFFAOYSA-N

Data  4 KI

  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 4 hits for monomerid = 50628591   

TargetNADPH oxidase 4(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50628591(Setanaxib | GKT-137831 | GKT-831 | SETANAXIB)
Affinity DataKi:  110nMAssay Description:Binding affinity to human NOX4 assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2024
Entry Details
PubMed
TargetNADPH oxidase 1(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50628591(Setanaxib | GKT-137831 | GKT-831 | SETANAXIB)
Affinity DataKi:  140nMAssay Description:Binding affinity to human NOX1 assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2024
Entry Details
PubMed
TargetNADPH oxidase 5(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50628591(Setanaxib | GKT-137831 | GKT-831 | SETANAXIB)
Affinity DataKi:  410nMAssay Description:Binding affinity to human NOX5 assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2024
Entry Details
PubMed
TargetCytochrome b-245 heavy chain(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50628591(Setanaxib | GKT-137831 | GKT-831 | SETANAXIB)
Affinity DataKi:  1.75E+3nMAssay Description:Binding affinity to human NOX2 assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2024
Entry Details
PubMed