BDBM50093538 3-(4-Hydroxyphenyl)-7-ethoxychromen-4-one::7-Ethoxy-3-(4-hydroxy-phenyl)-chromen-4-one::7-ethoxy-3-(4-hydroxyphenyl)-4H-chromen-4-one::CHEMBL115092
SMILES: CCOc1ccc2c(c1)occ(-c1ccc(O)cc1)c2=O
InChI Key: InChIKey=YMGLMEIZDQKJBW-UHFFFAOYSA-N
Data: 2 IC50
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Aldehyde dehydrogenase, mitochondrial (Homo sapiens (Human)) | BDBM50093538 (3-(4-Hydroxyphenyl)-7-ethoxychromen-4-one | 7-Etho...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/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 | |||||||||||||
Aldehyde dehydrogenase, mitochondrial (Homo sapiens (Human)) | BDBM50093538 (3-(4-Hydroxyphenyl)-7-ethoxychromen-4-one | 7-Etho...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Harvard Medical School Curated by ChEMBL | Assay Description Inhibition of Hamster Liver mitochondrial ALDH-2 | J Med Chem 43: 4169-79 (2000) BindingDB Entry DOI: 10.7270/Q2GX49T8 | |||||||||||
More data for this Ligand-Target Pair |