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

General Information of Drug (ID: DR0347)
Drug Name
Clofibrate
Synonyms
Chlorphenisate; Citiflus; Claripex; Clofibate; Clofibrato; Clofibratum; Clofinit; Amotril; Amotril S; Angiokapsul; Anparton; Antilipid; Antilipide; Apolan; Arterioflexin; Arterosol; Ateculon; Ateriosan; Athebrate; Atheromide; Atheropront; Atrolen; Atromid; Atromid-S; Atromida; Bioscleran; Ethyl chlorophenoxyisobutyrate; Ethyl clofibrate; Fibralem; Klofiran; Lipavil; Lipavlon; Lipofacton; Lipomid; Liprin; Liprinal; Lobetrin; Miscleron; Regardin; Serotinex; Ticlobran; Xyduril; clofibrate; 637-07-0; EPIB; Ethyl 2-(4-chlorophenoxy)-2-methylpropanoate
Indication Hypertriglyceridaemia [ICD11: 5C80] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 242.7 Topological Polar Surface Area 35.5
Heavy Atom Count 16 Rotatable Bond Count 5
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3
Cross-matching ID
PubChem CID
2796
PubChem SID
9133 ; 119396 ; 221613 ; 893268 ; 3218686 ; 4302581 ; 7847345 ; 7978969 ; 8147031 ; 8149997 ; 8150180 ; 8151805 ; 10531332 ; 10852042 ; 11110971 ; 11120027 ; 11120515 ; 11121003 ; 11121642 ; 11122122 ; 11147110 ; 11335997 ; 11336101 ; 11361236 ; 11361340 ; 11362711 ; 11364629 ; 11365273 ; 11367191 ; 11367835 ; 11369753 ; 11370693 ; 11370694 ; 11373436 ; 11374024 ; 11375997 ; 11377915 ; 11446100 ; 11452212 ; 11462208 ; 11462312 ; 11484734 ; 11489025 ; 11492038 ; 11495549 ; 14798427 ; 17404869 ; 22391427 ; 22395216 ; 24278085
ChEBI ID
ChEBI:3750
CAS Number
637-07-0
TTD Drug ID
D0J5DC
Formula
C12H15ClO3
Canonical SMILES
CCOC(=O)C(C)(C)OC1=CC=C(C=C1)Cl
InChI
1S/C12H15ClO3/c1-4-15-11(14)12(2,3)16-10-7-5-9(13)6-8-10/h5-8H,4H2,1-3H3
InChIKey
KNHUKKLJHYUCFP-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
1-O-clofibryl glucuronide DM006099 N. A. Conjugation - Glucuronidation 1 [4]
Clofibric acid DM006098
2797
Unclear 1 [6]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR006565 Clofibrate Clofibric acid Unclear Unclear [6]
MR006566 Clofibrate 1-O-clofibryl glucuronide Conjugation - Glucuronidation Unclear [4]
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Cytochrome P450 1A1 (CYP1A1) DME0006 Homo sapiens
CP1A1_HUMAN
1.14.14.1
[2]
Cytochrome P450 1A2 (CYP1A2) DME0003 Homo sapiens
CP1A2_HUMAN
1.14.14.1
[2]
Cytochrome P450 2A6 (CYP2A6) DME0005 Homo sapiens
CP2A6_HUMAN
1.14.14.1
[2]
Cytochrome P450 2B6 (CYP2B6) DME0020 Homo sapiens
CP2B6_HUMAN
1.14.14.1
[2]
Cytochrome P450 2C9 (CYP2C9) DME0019 Homo sapiens
CP2C9_HUMAN
1.14.14.1
[2]
Cytochrome P450 2D6 (CYP2D6) DME0009 Homo sapiens
CP2D6_HUMAN
1.14.14.1
[2]
Cytochrome P450 3A4 (CYP3A4) DME0001 Homo sapiens
CP3A4_HUMAN
1.14.14.55
[3]
Glutathione S-transferase alpha-1 (GSTA1) DME0011 Homo sapiens
GSTA1_HUMAN
2.5.1.18
[4]
Lauric acid omega-hydroxylase (CYP4A11) DME0029 Homo sapiens
CP4AB_HUMAN
1.14.15.3
[5]
⏷ Show the Full List of 9  DME(s)
References
1 Clofibrate was approved by FDA. The 2020 official website of the U.S. Food and Drug Administration.
2 Oxidative metabolism of flunarizine and cinnarizine by microsomes from B-lymphoblastoid cell lines expressing human cytochrome P450 enzymes. Biol Pharm Bull. 1996 Nov;19(11):1511-4.
3 Clinical pharmacokinetics of fibric acid derivatives (fibrates). Clin Pharmacokinet. 1998 Feb;34(2):155-62.
4 Characterization and formation of the glutathione conjugate of clofibric acid. Drug Metab Dispos. 1995 Jan;23(1):119-23.
5 Regulation of CYP2E1 by ethanol and palmitic acid and CYP4A11 by clofibrate in primary cultures of human hepatocytes. Toxicol Sci. 2004 Jun;79(2):233-41.
6 Biodegradation of clofibric acid and identification of its metabolites

If you find any error in data or bug in web service, please kindly report it to Dr. Yin and Dr. Li.