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

General Information of Drug (ID: DR0276)
Drug Name
Cariprazine hydrochloride
Synonyms
Cariprazine (hydrochloride); Cariprazine HCl; Cariprazine hydrochloride (JAN/USAN); Cariprazine hydrochloride [USAN]; D09876; EX-A1644; FT-0701196; HY-14763A; KQD7C255YG; KS-00000640; MFCD26142670; RGH-188 HCL; RGH-188 hydrochloride; RGH188 hydrochloride; SB16840; SCHEMBL183803; SCHEMBL183804; UNII-KQD7C255YG; Vraylar; Vraylar (TN); cariprazine monohydrochloride; cariprazine.HCl; 1083076-69-0; A15036; BCP24194; CARIPRAZINE HYDROCHLORIDE; CHEBI:90932; CHEMBL2024517; CS-1570
Indication Bipolar disorder [ICD11: 6A60] Approved [1]
Structure
3D MOL is unavailable 2D MOL
Pharmaceutical Properties Molecular Weight 463.9 Topological Polar Surface Area 38.8
Heavy Atom Count 29 Rotatable Bond Count 5
Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 3
Cross-matching ID
PubChem CID
25096873
ChEBI ID
CHEBI:90932
CAS Number
1083076-69-0
TTD Drug ID
D05XGO
Formula
C21H33Cl3N4O
Canonical SMILES
CN(C)C(=O)NC1CCC(CC1)CCN2CCN(CC2)C3=C(C(=CC=C3)Cl)Cl.Cl
InChI
1S/C21H32Cl2N4O.ClH/c1-25(2)21(28)24-17-8-6-16(7-9-17)10-11-26-12-14-27(15-13-26)19-5-3-4-18(22)20(19)23;/h3-5,16-17H,6-15H2,1-2H3,(H,24,28);1H
InChIKey
GPPJWWMREQHLQT-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
Desmethyl cariprazine DM000728
11338928
Oxidation - Demethylation 1 [2]
Didesmethyl cariprazine DM000729
11200383
Oxidation - Demethylation 1 [2]
Didesmethyl cariprazine DM000729
11200383
Oxidation - Demethylation 2 [2]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR003126 Cariprazine hydrochloride Desmethyl cariprazine Oxidation - Demethylation CYP3A4 ... [2]
MR003127 Cariprazine hydrochloride Didesmethyl cariprazine Oxidation - Demethylation CYP3A4 ... [2]
MR003125 Desmethyl cariprazine Didesmethyl cariprazine Oxidation - Demethylation CYP3A4 ... [2]
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]
Cytochrome P450 3A4 (CYP3A4) DME0001 Homo sapiens
CP3A4_HUMAN
1.14.14.55
[2]
References
1 Cariprazine Hydrochloride was approved by FDA. The 2020 official website of the U.S. Food and Drug Administration.
2 Cariprazine: chemistry, pharmacodynamics, pharmacokinetics, and metabolism, clinical efficacy, safety, and tolerability. Expert Opin Drug Metab Toxicol. 2013 Feb;9(2):193-206.

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