Reaction Details Report a problem with these data
Target
Alcohol dehydrogenase class-3
Ligand
BDBM50465820
Substrate
n/a
Meas. Tech.
ChEMBL_1788804 (CHEMBL4260538)
IC50
29±n/a nM
Citation
 Muthukaman, N; Deshmukh, S; Tondlekar, S; Tambe, M; Pisal, D; Sarode, N; Mhatre, S; Chakraborti, S; Shah, D; Bhosale, VM; Kulkarni, A; Mahat, MYA; Jadhav, SB; Gudi, GS; Khairatkar-Joshi, N; Gharat, LA Discovery of 5-(2-chloro-4'-(1H-imidazol-1-yl)-[1,1'-biphenyl]-4-yl)-1H-tetrazole as potent and orally efficacious S-nitrosoglutathione reductase (GSNOR) inhibitors for the potential treatment of COPD. Bioorg Med Chem Lett 28:3766-3773 (2018) [PubMed]  Article 
Target
Name:
Alcohol dehydrogenase class-3
Synonyms:
1.1.1.- | 1.1.1.1 | 1.1.1.284 | ADH5 | ADHX | ADHX_HUMAN | Alcohol dehydrogenase 5 | Alcohol dehydrogenase class chi chain | Alcohol dehydrogenase class-3 | Alcohol dehydrogenase class-III | FALDH | FDH | Glutathione-dependent formaldehyde dehydrogenase (GSH-FDH) | S-nitrosoglutathione reductase (GSNOR) | alcohol dehydrogenase 3 (ADH-3)
Type:
n/a
Mol. Mass.:
39728.34
Organism:
Homo sapiens (Human)
Description:
P11766
Residue:
374
Sequence:
MANEVIKCKAAVAWEAGKPLSIEEIEVAPPKAHEVRIKIIATAVCHTDAYTLSGADPEGCFPVILGHEGAGIVESVGEGVTKLKAGDTVIPLYIPQCGECKFCLNPKTNLCQKIRVTQGKGLMPDGTSRFTCKGKTILHYMGTSTFSEYTVVADISVAKIDPLAPLDKVCLLGCGISTGYGAAVNTAKLEPGSVCAVFGLGGVGLAVIMGCKVAGASRIIGVDINKDKFARAKEFGATECINPQDFSKPIQEVLIEMTDGGVDYSFECIGNVKVMRAALEACHKGWGVSVVVGVAASGEEIATRPFQLVTGRTWKGTAFGGWKSVESVPKLVSEYMSKKIKVDEFVTHNLSFDEINKAFELMHSGKSIRTVVKI
  
Inhibitor
Name:
BDBM50465820
Synonyms:
CHEMBL4285078
Type:
Small organic molecule
Emp. Form.:
C17H14N2O2
Mol. Mass.:
278.3053
SMILES:
Cc1cc(ccc1-c1ccc(cc1)-n1ccnc1)C(O)=O
Structure:
Search PDB for entries with ligand similarity: