BDBM50557953 CHEBI:19062::CHEMBL3246759

SMILES CN1C(=O)c2c(n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=C1N

InChI Key InChIKey=UTAIYTHAJQNQDW-UHFFFAOYSA-N

Data  1 IC50

PDB links: 1 PDB ID matches this monomer.

  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 1 hit for monomerid = 50557953   

TargetCholine trimethylamine-lyase(Desulfovibrio alaskensis (strain ATCC BAA 1058 / D...)
Stanford University School

Curated by ChEMBL
LigandPNGBDBM50557953(CHEBI:19062 | CHEMBL3246759)
Affinity DataIC50: 1.10E+5nMAssay Description:Inhibition of N-terminal His6-tagged Desulfovibrio desulfuricans G20 CutC encoding 52 residues assessed as reduction in acetaldehyde using choline as...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/27/2022
Entry Details Article
PubMed