Basic Description

Specifications & Purity	Moligand™
Grade	Moligand™
Action Type	INHIBITOR
Mechanism of action	Inhibitor of transglutaminase 2

Associated Targets(Human)

TGM2 Tchem Protein-glutamine gamma-glutamyltransferase 2 (1 Activities)

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Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

TGM3 Tchem Protein-glutamine glutamyltransferase E (94 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TGM1 Tchem Protein-glutamine gamma-glutamyltransferase K (164 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TGM2 Tchem Protein-glutamine gamma-glutamyltransferase (1221 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

F13A1 Tchem Coagulation factor XIII (223 Activities)

Discover Target: F13A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TXN Tchem Thioredoxin (111 Activities)

Discover Target: TXN

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Mus musculus (284745 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Plasma (328 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	quinolin-3-ylmethyl (2S)-2-[[(5S)-3-bromo-4,5-dihydro-1,2-oxazol-5-yl]methylcarbamoyl]pyrrolidine-1-carboxylate
INCHI	InChI=1S/C20H21BrN4O4/c21-18-9-15(29-24-18)11-23-19(26)17-6-3-7-25(17)20(27)28-12-13-8-14-4-1-2-5-16(14)22-10-13/h1-2,4-5,8,10,15,17H,3,6-7,9,11-12H2,(H,23,26)/t15-,17-/m0/s1
InChi Key	FDWIPZHANLQVMF-RDJZCZTQSA-N
Canonical SMILES	O=C([C@@H]1CCCN1C(=O)OCc1cnc2c(c1)cccc2)NC[C@H]1ON=C(C1)Br
Isomeric SMILES	C1C[C@H](N(C1)C(=O)OCC2=CC3=CC=CC=C3N=C2)C(=O)NC[C@@H]4CC(=NO4)Br
PubChem CID	16094751

Database links

PubChem CID	16094751
BindingDB Ligand	50200156
ChEMBL Ligand	CHEMBL219514

Certificates

Certificate of Analysis(COA)

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References

1. Watts RE, Siegel M, Khosla C. (2006) Structure-activity relationship analysis of the selective inhibition of transglutaminase 2 by dihydroisoxazoles.. J Med Chem, 49 (25): (7493-501). [PMID:17149878] [10.1021/op500134e]
2. Dafik L, Albertelli M, Stamnaes J, Sollid LM, Khosla C. (2012) Activation and inhibition of transglutaminase 2 in mice.. PLoS ONE, 7 (2): (e30642). [PMID:22319575] [10.1021/op500134e]
3. Chrobok NL, Bol JGJM, Jongenelen CA, Brevé JJP, El Alaoui S, Wilhelmus MMM, Drukarch B, van Dam AM. (2018) Characterization of Transglutaminase 2 activity inhibitors in monocytes in vitro and their effect in a mouse model for multiple sclerosis.. PLoS ONE, 13 (4): (e0196433). [PMID:29689097] [10.1371/journal.pone.0196433]

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SKU	Size	Availability	Price	Qty
E610184-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$600.90
E610184-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,000.90

ERW1041E , CAS No.E610184, Inhibitor of transglutaminase 2