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

General Information of Drug (ID: DR1084)
Drug Name
Miconazole
Synonyms
Miconazol; Miconazol [INN-Spanish]; Miconazole 3; Miconazole-7; Miconazolo; Miconazolo [DCIT]; Miconazolum; Miconazolum [INN-Latin]; Micozole; Minostate; Monazole 7; Monistat; Monistat 1 Combination Pack; Monistat IV; Monistat-Derm; R 18134; Brentan; Dactarin; Daktarin; Daktarin IV; Femizol-M; Florid(nitrate); MJR 1762; Vusion; Zimycan; miconazole; 1-(2-((2,4-Dichlorobenzyl)oxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole; 1-[2-(2,4-Dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-1H-imidazole; 22916-47-8; C18H14Cl4N2O; NSC 170986
Indication Dermatophytosis [ICD11: 1F28] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 416.1 Topological Polar Surface Area 27
Heavy Atom Count 25 Rotatable Bond Count 6
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2
Cross-matching ID
PubChem CID
4189
PubChem SID
443253 ; 602748 ; 853814 ; 5025447 ; 7847482 ; 7979986 ; 8152620 ; 10321394 ; 10514422 ; 11112680 ; 11335331 ; 11360570 ; 11363859 ; 11366421 ; 11368983 ; 11371633 ; 11373720 ; 11377145 ; 11405748 ; 11405775 ; 11461542 ; 11466095 ; 11467215 ; 11484712 ; 11485910 ; 11488864 ; 11490323 ; 11491876 ; 11494779 ; 14806704 ; 25710691 ; 29223294 ; 46506017 ; 47365044 ; 47588856 ; 47736333 ; 47810615 ; 47885276 ; 48034973 ; 48259081 ; 48259082 ; 48416278 ; 49698872 ; 49979412 ; 53789980 ; 53801024 ; 56310764 ; 56311695 ; 56312816 ; 56313686
ChEBI ID
ChEBI:6923
CAS Number
22916-47-8
TTD Drug ID
D00AXJ
Formula
C18H14Cl4N2O
Canonical SMILES
C1=CC(=C(C=C1Cl)Cl)COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl
InChI
1S/C18H14Cl4N2O/c19-13-2-1-12(16(21)7-13)10-25-18(9-24-6-5-23-11-24)15-4-3-14(20)8-17(15)22/h1-8,11,18H,9-10H2
InChIKey
BYBLEWFAAKGYCD-UHFFFAOYSA-N
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Cytochrome P450 3A4 (CYP3A4) DME0001 Homo sapiens
CP3A4_HUMAN
1.14.14.55
[2]
References
1 Miconazole was approved by FDA. The 2020 official website of the U.S. Food and Drug Administration.
2 Inhibition of cytochrome P450 enzymes participating in p-nitrophenol hydroxylation by drugs known as CYP2E1 inhibitors. Chem Biol Interact. 2004 Apr 15;147(3):331-40.

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