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

General Information of Drug (ID: DR1788)
Drug Name
CGP-11305A
Synonyms
Brofaremine; Brofaromina; Brofaromina [Spanish]; Brofaromine; Brofaromine (INN); Brofaromine [INN]; Brofarominum; Brofarominum [Latin]; Consonar; Consonar (TN); brofaromin; 4-(7-Bromo-5-methoxy-2-benzofuranyl)piperidine; 4-(7-Bromo-5-methoxy-benzofuran-2-yl)-piperidine; 4-(7-bromo-5-methoxy-1-benzofuran-2-yl)piperidine; 63638-91-5; 6WV4B8Q07H; C14H16BrNO2; CGP 11305; CGP 11305A; CHEMBL160347; Piperidine, 4-(7-bromo-5-methoxy-2-benzofuranyl)-; Piperidine, 4-(7-bromo-5-methoxy-2-benzofuranyl)-, hydrochloride; UNII-6WV4B8Q07H
Indication Anxiety disorder [ICD11: 6B00] Discontinued [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 310.19 Topological Polar Surface Area 34.4
Heavy Atom Count 18 Rotatable Bond Count 2
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3
Cross-matching ID
PubChem CID
44571
CAS Number
63638-91-5
TTD Drug ID
D0IZ1D
Formula
C14H16BrNO2
Canonical SMILES
COC1=CC(=C2C(=C1)C=C(O2)C3CCNCC3)Br
InChI
1S/C14H16BrNO2/c1-17-11-6-10-7-13(9-2-4-16-5-3-9)18-14(10)12(15)8-11/h6-9,16H,2-5H2,1H3
InChIKey
WZXHSWVDAYOFPE-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
O-desmethyl-brofaromine DM005557
129154
Unclear 1 [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR013662 CGP-11305A O-desmethyl-brofaromine Unclear CYP2D6 [3]
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Cytochrome P450 2D6 (CYP2D6) DME0009 Homo sapiens
CP2D6_HUMAN
1.14.14.1
[2]
References
1 Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800000689)
2 Role of cytochrome P4502D6 in the metabolism of brofaromine. A new selective MAO-A inhibitor. Eur J Clin Pharmacol. 1993;45(3):265-9.
3 Determination of the new monoamine oxidase inhibitor brofaromine and its major metabolite in biological material by gas chromatography with electron-capture detection

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