BDBM50136875 4-(2,3-Dihydro-indol-1-yl)-4-oxo-butyric acid::CHEMBL357516

SMILES c1ccc2c(c1)CCN2C(=O)CCC(=O)O

InChI Key InChIKey=SWNRXQYQTQVWKA-UHFFFAOYSA-N

Data  3 IC50

PDB links: 2 PDB IDs match this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50136875   

TargetAldo-keto reductase family 1 member B1(Pig)
Yonsei University

Curated by ChEMBL
LigandPNGBDBM50136875(4-(2,3-Dihydro-indol-1-yl)-4-oxo-butyric acid | CH...)
Affinity DataIC50: 1.02E+5nMAssay Description:Inhibition of pig kidney aldose reductase (ALR2)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetPalmitoleoyl-protein carboxylesterase NOTUM(Human)
University of Oxford

Curated by ChEMBL
LigandPNGBDBM50136875(4-(2,3-Dihydro-indol-1-yl)-4-oxo-butyric acid | CH...)
Affinity DataIC50: 3.10E+3nMAssay Description:Covalent inhibition of glycosylated Notum 1 (unknown origin) using OPTS as reporter substrate incubated for 40 mins by microplate reader based analys...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/4/2023
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetPalmitoleoyl-protein carboxylesterase NOTUM(Human)
University of Oxford

Curated by ChEMBL
LigandPNGBDBM50136875(4-(2,3-Dihydro-indol-1-yl)-4-oxo-butyric acid | CH...)
Affinity DataIC50: 3.10E+3nMAssay Description:Inhibition of human recombinant Notum (81 to T451 residues) expressed in HEK293S cells using OPTS as substrate incubated for 40 mins by microplate re...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/17/2024
Entry Details
PubMedPDB3D3D Structure (crystal)