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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Prostaglandin E2 receptor EP3 subtype
Species	Bos taurus (Bovine)
Gene	PTGER3
Synonym	PGE receptor EP3 subtype PGE2 receptor EP3 subtype Prostanoid EP3 receptor
Disease	N/A for non-human GPCRs
Length	417
Amino acid sequence	MKATRDHASAPFCTRFNHSDPGIWAAERAVEAPNNLTLPPEPSEDCGSVSVAFSMTMMITGFVGNALAITLVSKSYRRREGKRKKSFLLCIGWLALTDMVGQLLTSPVVIVLYLSHQRWEQLDPSGRLCTFFGLTMTVFGLSSLFIASAMAVERALATRAPHWYSSHMKTSVTRAVLLGVWLAVLAFALLPVLGVGQYTIQWPGTWCFISTGPGGNGTNSRQNWGNVFFASAFAILGLSALVVTFACNLATIKALVSRCRAKATASQSSAQWGRITTETAIQLMGIMCVLSVCWSPLLIMMLKMIFNHTSVEHCKTYTENQDECNFFLIAVRLASLNQILDPWVYLLLRKILLQKFCQLLKGHSYGLDTEGGTENKDKEMKENLYISNLSRFFILLGHFTEARRGRGHIYLHTLEHQ
UniProt	P34979
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	N/A
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	SC 19220
Molecular formula	C16H14ClN3O3
IUPAC name	N'-acetyl-3-chloro-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide
Molecular weight	331.756
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	2.3
Synonyms	N'-acetyl-3-chloro-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide NCGC00025038-02 SC19220 ZINC2392218 19395-87-0 BDBM85341 D0OA8M KNURFLJTOUGOOQ-UHFFFAOYSA-N NCGC00015943-02 NSC_4336830 SR-01000076128 8-Chloro-dibenz[b,f][1,4]oxazepine-10(11H)-carboxylic acid CCG-205174 HMS2231G10 Lopac0_001097 MLS000862188 NCGC00015943-05 SC 19220, >=98% (HPLC), solid Tocris-1206 AKOS024456464 CHEMBL112816 HMS3370E15 N'-acetyl-3-chloro-6H-benzo[b][1,5]benzoxazepine-5-carbohydrazide NCGC00025038-03 SCHEMBL12648484 2-Acetylhydrazide 10(11H)-carboxylic acid BRD-K52512893-001-03-0 EU-0101097 L024046 NCGC00015943-03 S 3065 SR-01000076128-2 8-Chlorodibenz[b,f][1,4]oxazepine-10(11H)-carboxy-(2-acetyl)hydrazide CHEBI:92916 HMS3263K16 LP01097 MolPort-003-959-528 NCGC00025038-01 SC-19220 Tox21_501097 B6633 CTK8G3065 J-012559 NCGC00015943-01 NCGC00261782-01 SMR000326951 8-Chloro-dibenzo(Z)[b,f][1,4]oxazepine-10(11H)-carboxylic acid, 2-acetylhydrazide CAS_4336830 GTPL1922 Lopac-S-3065 NCGC00015943-04 SR-01000076128-3 AC1N81PQ HMS3267B11 MFCD02259329 [ Show all ]
Inchi Key	KNURFLJTOUGOOQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H14ClN3O3/c1-10(21)18-19-16(22)20-9-11-4-2-3-5-14(11)23-15-7-6-12(17)8-13(15)20/h2-8H,9H2,1H3,(H,18,21)(H,19,22)
PubChem CID	4336830
ChEMBL	CHEMBL112816
IUPHAR	1922
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	<10000.0 nM	PMID9694973	PDSP
Ki	3000.0 nM	PMID9694973	PDSP

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