Reaction Details Report a problem with these data
Target
NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 9
Ligand
BDBM50490815
Substrate
n/a
Meas. Tech.
ChEMBL_951838 (CHEMBL2353251)
IC50
15100±n/a nM
Citation
 Li, J; Mahdi, F; Du, L; Jekabsons, MB; Zhou, YD; Nagle, DG Semisynthetic studies identify mitochondria poisons from botanical dietary supplements--geranyloxycoumarins from Aegle marmelos. Bioorg Med Chem 21:1795-803 (2013) [PubMed]  Article 
Target
Name:
NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 9
Synonyms:
CI-B22 | Complex I-B22 | LYR motif-containing protein 3 | LYRM3 | NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 9 | NADH-ubiquinone oxidoreductase B22 subunit | NDUB9_HUMAN | NDUFB9 | UQOR22
Type:
PROTEIN
Mol. Mass.:
21836.20
Organism:
Homo sapiens
Description:
ChEMBL_105760
Residue:
179
Sequence:
MAFLASGPYLTHQQKVLRLYKRALRHLESWCVQRDKYRYFACLMRARFEEHKNEKDMAKATQLLKEAEEEFWYRQHPQPYIFPDSPGGTSYERYDCYKVPEWCLDDWHPSEKAMYPDYFAKREQWKKLRRESWEREVKQLQEETPPGGPLTEALPPARKEGDLPPLWWYIVTRPRERPM
  
Inhibitor
Name:
BDBM50490815
Synonyms:
Dehydromarmeline
Type:
Small organic molecule
Emp. Form.:
C22H25NO2
Mol. Mass.:
335.4394
SMILES:
[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1ccc(-[#6]-[#6]-[#7]-[#6](=O)\[#6]=[#6]\c2ccccc2)cc1
Structure:
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