Details of the Drug Metabolized by Drug-Metabolizing Enzyme (DME)

General Information of Drug (ID: DR0341)
Drug Name
Clioquinol
Synonyms
Chinoform; Chloroiodoquin; Chloroiodoquine; Chlorojodochin; Cliquinol; Dermaform; Dioquinol; Alchloquin; Budoform; Eczecidin; Entero-Vioform; Enteroquinol; Enterseptol; Iodenterol; Iodochlorhydroxyquin; Iodochlorhydroxyquinoline; Iodochlorohydroxyquinoline; Iodochloroquine; Iodochloroxine; Iodochloroxyquinoline; Iodoenterol; Iodoxyquinoline; Lekosept; Quinambicide; Quinoform; Rheaform; Vioform; clioquinol; 130-26-7; 5-Chloro-7-iodo-8-quinolinol; 5-Chloro-7-iodoquinolin-8-ol; 5-Chloro-8-hydroxy-7-iodoquinoline; 7-Iodo-5-chloroxine
Indication Protozoan infection [ICD11: 1F5Z] Phase 4 [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 305.5 Topological Polar Surface Area 33.1
Heavy Atom Count 13 Rotatable Bond Count 0
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2
Cross-matching ID
PubChem CID
2788
ChEBI ID
CHEBI:74460
CAS Number
130-26-7
TTD Drug ID
D06ABW
Formula
C9H5ClINO
Canonical SMILES
C1=CC2=C(C(=C(C=C2Cl)I)O)N=C1
InChI
1S/C9H5ClINO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H
InChIKey
QCDFBFJGMNKBDO-UHFFFAOYSA-N
The Metabolic Roadmap of This Drug
The Full List of Drug Metabolites (DM) of This Drug
DM Name DM ID PubChem ID Reaction DM Level REF
ICQ-G DM003169 N. A. Conjugation - Glucuronidation 1 [3]
ICQ-S DM003168 N. A. Conjugation - Sulfation 1 [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR003611 Clioquinol ICQ-S Conjugation - Sulfation Unclear [3]
MR003612 Clioquinol ICQ-G Conjugation - Glucuronidation Unclear [3]
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Sulfotransferase 1A1 (SULT1A1) DME0008 Homo sapiens
ST1A1_HUMAN
2.8.2.1
[2]
References
1 Hydroxyquinolines inhibit ribonucleic acid-dependent deoxyribonucleic acid polymerase and inactivate Rous sarcoma virus and herpes simplex virus. Antimicrob Agents Chemother. 1976 Aug;10(2):234-40.
2 Clioquinol is sulfated by human jejunum cytosol and SULT1A3, a human-specific dopamine sulfotransferase. Toxicol Lett. 2011 Oct 10;206(2):229-33.
3 Metabolism of 14C-iodochlorhydroxyquin in the dog and the rat

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