BDBM50002739 CHEBI:69565::YUANHUADINE::Yuanhuadine

SMILES C=C(C)[C@@]12O[C@@]3(/C=C/C=C/CCCCC)O[C@@H]1[C@@H]1[C@@H]4O[C@]4(CO)[C@@H](O)[C@]4(O)C(=O)C(C)=C[C@H]4[C@@]1(O3)[C@H](C)[C@H]2OC(C)=O

InChI Key InChIKey=NHELFTYSELEEFD-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50002739   

TargetNicotinamide N-methyltransferase(Human)
Purdue University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50002739BDBM50002739(YUANHUADINE | CHEBI:69565 | Yuanhuadine)
Affinity DataIC50: 4.00E+3nMAssay Description:Inhibition of NNMT (unknown origin) assessed as formation of MNA using nicotinamide as substrate and SAM as cofactor by fluorescence based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details Article
PubMed