BDBM50295341 CHEMBL3597020

SMILES CC1(CCC(CC1)CC2=CC(=C(C(=O)N2)c3ccccc3)O)C

InChI Key InChIKey=WKDRRKVUJLNFSR-UHFFFAOYSA-N

Data  2 IC50

PDB links: 3 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50295341   

TargetEnoyl-[acyl-carrier-protein] reductase [NADH](Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Cnrs

Curated by ChEMBL
LigandPNGBDBM50295341(CHEMBL3597020)
Affinity DataIC50: 570nMAssay Description:Inhibition of Mycobacterium tuberculosis InhA using trans-2-dodecenoyl-CoA as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/6/2020
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetEnoyl-[acyl-carrier-protein] reductase [NADH](Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Cnrs

Curated by ChEMBL
LigandPNGBDBM50295341(CHEMBL3597020)
Affinity DataIC50: 570nMAssay Description:Inhibition of Mycobacterium tuberculosis ATCC 25618 InhAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMedPDB3D3D Structure (crystal)