ademetionine 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definition	Drug id	CAS RN
	2414	29908-03-0

Description:

Molecule	Description
Molfile Inchi Smiles Synonyms: ademetionin methioninyl adenylate s-adenosylmethionine ademetionine donamet	Physiologic methyl radical donor involved in enzymatic transmethylation reactions and present in all living organisms. It possesses anti-inflammatory activity and has been used in treatment of chronic liver disease. (From Merck, 11th ed) Molecular weight: 398.44 Formula: C15H22N6O5S CLOGP: -4.28 LIPINSKI: 1 HAC: 11 HDO: 4 TPSA: 185.46 ALOGS: -2.45 ROTB: 7

Molecule

Description

Molfile Inchi Smiles

Synonyms:

ademetionin
methioninyl adenylate
s-adenosylmethionine
ademetionine
donamet

Physiologic methyl radical donor involved in enzymatic transmethylation reactions and present in all living organisms. It possesses anti-inflammatory activity and has been used in treatment of chronic liver disease. (From Merck, 11th ed)

Molecular weight: 398.44
Formula: C15H22N6O5S
CLOGP: -4.28
LIPINSKI: 1
HAC: 11
HDO: 4
TPSA: 185.46
ALOGS: -2.45
ROTB: 7

Drug dosage:

None

ADMET properties:

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Property	Value	Reference
MRTD (Maximum Recommended Therapeutic Daily Dose)	62.74 µM/kg/day	Contrera JF, Matthews EJ, Kruhlak NL, Benz RD
BA (Bioavailability)	5 %	Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H

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Approvals:

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FDA Adverse Event Reporting System (Female)

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MedDRA adverse event term	Likelihood ratio	Likelihood ratio threshold	Patients taking drug having adverse event	Patients taking drug not having adverse event	Patients not taking drug having adverse event	Patients not taking drug not having adverse event
Confabulation	119.28	41.81	16	668	304	63488034
Serotonin syndrome	76.82	41.81	23	661	28659	63459679
Nystagmus	71.86	41.81	16	668	6204	63482134
Drug interaction	61.07	41.81	35	649	229096	63259242
Right aortic arch	56.22	41.81	8	676	236	63488102
Rhabdomyolysis	55.62	41.81	20	664	43931	63444407
Congenital arterial malformation	53.63	41.81	8	676	329	63488009
Dyskinesia	45.93	41.81	16	668	31986	63456352
Mechanical urticaria	43.57	41.81	7	677	469	63487869

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FDA Adverse Event Reporting System (Male)

None

FDA Adverse Event Reporting System (Geriatric)

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MedDRA adverse event term	Likelihood ratio	Likelihood ratio threshold	Patients taking drug having adverse event	Patients taking drug not having adverse event	Patients not taking drug having adverse event	Patients not taking drug not having adverse event
Confabulation	113.35	33.74	16	782	482	79743108
Serotonin syndrome	68.23	33.74	23	775	45004	79698586
Nystagmus	65.61	33.74	16	782	9888	79733702
Rhabdomyolysis	46.62	33.74	22	776	103109	79640481
Drug interaction	42.20	33.74	34	764	415149	79328441
Dyskinesia	41.81	33.74	16	782	44757	79698833
Mechanical urticaria	37.34	33.74	6	792	433	79743157

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FDA Adverse Event Reporting System (Pediatric)

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Pharmacologic Action:

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Source	Code	Description
ATC	A16AA02	ALIMENTARY TRACT AND METABOLISM OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS Amino acids and derivatives
CHEBI has role	CHEBI:23354	coenzymes
CHEBI has role	CHEBI:23357	cofactor
CHEBI has role	CHEBI:27027	trace elements
CHEBI has role	CHEBI:50733	Dietary Supplement
CHEBI has role	CHEBI:75772	S. cerevisiae metabolites
CHEBI has role	CHEBI:77746	Homo sapiens metabolite
CHEBI has role	CHEBI:131604	Mycoplasma genitalium metabolites

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Drug Use | Suggest Off label Use Form| |View source of the data|

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Disease	Relation	SNOMED_ID	DOID
Hypertensive disorder	contraindication	38341003	DOID:10763
Hyperlipidemia	contraindication	55822004	DOID:1168
Diabetes mellitus	contraindication	73211009	DOID:9351

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🐶 Veterinary Drug Use

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🐶 Veterinary products

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Acid dissociation constants calculated using MoKa v3.0.0

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Dissociation level	Dissociation constant	Type (acidic/basic)
pKa1	2.53	acidic
pKa2	12.47	acidic
pKa3	9.91	Basic
pKa4	3.95	Basic

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Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

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Target	Class	Pharos	UniProt	Type	Activity value (-log[M])	Bioact source
Protein arginine N-methyltransferase 1	Enzyme	Q99873	ANM1_HUMAN	IC50	4.92	CHEMBL
Phenylethanolamine N-methyltransferase	Enzyme	P11086	PNMT_HUMAN	Kd	5.32	CHEMBL
Protein-beta-aspartate methyltransferase	Enzyme	P22061	PIMT_HUMAN	Ki	4.32	CHEMBL
S-adenosylmethionine decarboxylase proenzyme	Enzyme		DCAM_RAT	Ki	4.22	CHEMBL
Met repressor	Unclassified		C3SIU2_ECOLX	Kd	8.40	CHEMBL

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External reference:

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ID	Source
SAM	PDB_CHEM_ID
004313	NDDF
008834	NDDF
27892	MMSL
34755	PUBCHEM_CID
365023	MMSL
4021429	VUID
4021429	VANDF
441671005	SNOMEDCT_US
441816007	SNOMEDCT_US

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Pharmaceutical products:

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