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Target
Alcohol dehydrogenase E/S chain
Ligand
BDBM50224819
Substrate
n/a
Meas. Tech.
ChEMBL_30849 (CHEMBL643567)
Ki
140000000±n/a nM
Citation
 Chadha, VK; Leidal, KG; Plapp, BV Inhibition by carboxamides and sulfoxides of liver alcohol dehydrogenase and ethanol metabolism. J Med Chem 26:916-22 (1983) [PubMed]  Article 
Target
Name:
Alcohol dehydrogenase E/S chain
Synonyms:
Alcohol dehydrogenase
Type:
n/a
Mol. Mass.:
n/a
Description:
ASSAY_ID of ChEMBL is 30849
Components:
This complex has 2 components.
Component 1
Name:
Alcohol dehydrogenase E chain
Synonyms:
1.1.1.1 | ADH1E_HORSE | Alcohol dehydrogenase E chain
Type:
PROTEIN
Mol. Mass.:
39942.66
Organism:
Equus caballus
Description:
ChEMBL_105061
Residue:
375
Sequence:
MSTAGKVIKCKAAVLWEEKKPFSIEEVEVAPPKAHEVRIKMVATGICRSDDHVVSGTLVTPLPVIAGHEAAGIVESIGEGVTTVRPGDKVIPLFTPQCGKCRVCKHPEGNFCLKNDLSMPRGTMQDGTSRFTCRGKPIHHFLGTSTFSQYTVVDEISVAKIDAASPLEKVCLIGCGFSTGYGSAVKVAKVTQGSTCAVFGLGGVGLSVIMGCKAAGAARIIGVDINKDKFAKAKEVGATECVNPQDYKKPIQEVLTEMSNGGVDFSFEVIGRLDTMVTALSCCQEAYGVSVIVGVPPDSQNLSMNPMLLLSGRTWKGAIFGGFKSKDSVPKLVADFMAKKFALDPLITHVLPFEKINEGFDLLRSGESIRTILTF
  
Component 2
Name:
Alcohol dehydrogenase S chain
Synonyms:
1.1.1.1 | ADH1S_HORSE | Alcohol dehydrogenase S chain
Type:
PROTEIN
Mol. Mass.:
39633.49
Organism:
Equus caballus
Description:
ChEMBL_105061
Residue:
374
Sequence:
MSTAGKVIKCKAAVLWEQKKPFSIEEVEVAPPKAHEVRIKMVAAGICRSDDHVVSGTLVAPLPVIAGHEAAGIVESIGEGVTTVRPGDKVIPLFIPQCGKCSVCKHPEGNLCLKNLSMPRGTMQDGTSRFTCRGKPIHHFLGTSTFSQYTVVDEISVAKIDAASPLEKVCLVGCGFSTGYGSAVKVAKVTQGSTCAVFGLGGVGLSVIMGCKAAGAARIIGVDINKDKFAKAKEVGATECVNPQDYKKPIQEVLTEMSNGGVDFSFEVIGRLDTMVAALSCCQEAYGVSVIVGVPPDSQNLSMNPMLLLSGRTWKGAIFGGFKSKDSVPKLVADFMAKKFALDPLITHVLPFEKINEGFDLLRSGKSIRTILTF
  
Inhibitor
Name:
BDBM50224819
Synonyms:
CHEMBL171795
Type:
Small organic molecule
Emp. Form.:
C4H8O2S2
Mol. Mass.:
152.235
SMILES:
[O-][S+]1CC[S+]([O-])CC1 |(8.17,-10.15,;8.17,-8.61,;6.85,-7.83,;6.85,-6.29,;8.17,-5.53,;8.16,-3.99,;9.5,-6.28,;9.5,-7.82,)|
Structure:
Search PDB for entries with ligand similarity: