ONO-4817

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H28N2O6
Molecular Weight	416.4675
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCOCOC[C@H](C[C@H](C)C(=O)NO)NC(=O)C1=CC=C(OC2=CC=CC=C2)C=C1

InChI

InChIKey=HDWWQELUBWGQGA-WMZOPIPTSA-N

InChI=1S/C22H28N2O6/c1-3-28-15-29-14-18(13-16(2)21(25)24-27)23-22(26)17-9-11-20(12-10-17)30-19-7-5-4-6-8-19/h4-12,16,18,27H,3,13-15H2,1-2H3,(H,23,26)(H,24,25)/t16-,18-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H28N2O6
Molecular Weight	416.4675
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Potency
Matrix metalloproteinase-2 13 Target ID: CHEMBL333 Sources: https://www.ncbi.nlm.nih.gov/pubmed/10858013	Inhibitor 8297	0.72 nM [Ki]
Matrix metalloproteinase 8 6 Target ID: CHEMBL4588 Sources: https://www.ncbi.nlm.nih.gov/pubmed/10858013	Inhibitor 8297	1.1 nM [Ki]
Matrix metalloproteinase 9 20 Target ID: CHEMBL321 Sources: https://www.ncbi.nlm.nih.gov/pubmed/10858013	Inhibitor 8297	2.1 nM [Ki]
Macrophage metalloelastase 1 Target ID: P39900 Gene ID: 4321.0 Gene Symbol: MMP12 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/10858013	Inhibitor 8297	0.45 nM [Ki]
Matrix metalloproteinase 13 8 Target ID: CHEMBL280 Sources: https://www.ncbi.nlm.nih.gov/pubmed/10858013	Inhibitor 8297	1.1 nM [Ki]

PubMed

Title	Date	PubMed
ONO-4817, an orally active matrix metalloproteinase inhibitor, prevents lipopolysaccharide-induced proteoglycan release from the joint cartilage in guinea pigs.	2000 Apr	10858013
Significance of matrix metalloproteinase-9 in cardiac dysfunction during the very acute phase after myocardial infarction in hamsters.	2007 Oct 15	17643409

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:54:25 GMT 2023` Edited by `admin` on `Fri Dec 15 18:54:25 GMT 2023`
Record UNII	RU48RF5PFC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ONO-4817

Code

English

N-((1S,3S)-1-((ETHOXYMETHOXY)METHYL)-4-(HYDROXYAMINO)-3-METHYL-4-OXOBUTYL)-4-PHENOXYBENZAMIDE

Systematic Name

English

(-)-ONO-4817

Common Name

English

BENZAMIDE, N-((1S,3S)-1-((ETHOXYMETHOXY)METHYL)-4-(HYDROXYAMINO)-3-METHYL-4-OXOBUTYL)-4-PHENOXY-

Systematic Name

English

ONO4817

Code

English

Code System Code Type Description

CAS

223472-31-9

Created by admin on Fri Dec 15 18:54:25 GMT 2023 , Edited by admin on Fri Dec 15 18:54:25 GMT 2023

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FDA UNII

RU48RF5PFC

Created by admin on Fri Dec 15 18:54:25 GMT 2023 , Edited by admin on Fri Dec 15 18:54:25 GMT 2023

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PUBCHEM

9888141

Created by admin on Fri Dec 15 18:54:25 GMT 2023 , Edited by admin on Fri Dec 15 18:54:25 GMT 2023

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Related Record Type Details


					RU48RF5PFC

ONO-4817

ACTIVE MOIETY