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BDBM50104902 7-Methyl-4-phenyl-chroman-2-one::CHEMBL109925

SMILES: Cc1ccc2C(CC(=O)Oc2c1)c1ccccc1

InChI Key: InChIKey=DVIONHZDAYXRBA-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50104902   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Aldehyde dehydrogenase, mitochondrial


(Homo sapiens (Human))
BDBM50104902
PNG
(7-Methyl-4-phenyl-chroman-2-one | CHEMBL109925)
Show SMILES Cc1ccc2C(CC(=O)Oc2c1)c1ccccc1
Show InChI InChI=1S/C16H14O2/c1-11-7-8-13-14(12-5-3-2-4-6-12)10-16(17)18-15(13)9-11/h2-9,14H,10H2,1H3
PDB
MMDB

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PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of hamster liver aldehyde dehydrogenase ALDH-2


J Med Chem 44: 3320-8 (2001)


BindingDB Entry DOI: 10.7270/Q2CC0ZZZ
More data for this
Ligand-Target Pair