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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	Sphingosine 1-phosphate receptor 3
Species	Homo sapiens (Human)
Gene	S1PR3
Synonym	Sphingosine 1-phosphate receptor Edg-3 S1P3 receptor S1P3 S1P receptor Edg-3 S1P receptor 3 Endothelial differentiation G-protein coupled receptor 3 endothelial differentiation G protein-coupled receptor 3 edg3 [ Show all ]
Disease	Breast cancer
Length	378
Amino acid sequence	MATALPPRLQPVRGNETLREHYQYVGKLAGRLKEASEGSTLTTVLFLVICSFIVLENLMVLIAIWKNNKFHNRMYFFIGNLALCDLLAGIAYKVNILMSGKKTFSLSPTVWFLREGSMFVALGASTCSLLAIAIERHLTMIKMRPYDANKRHRVFLLIGMCWLIAFTLGALPILGWNCLHNLPDCSTILPLYSKKYIAFCISIFTAILVTIVILYARIYFLVKSSSRKVANHNNSERSMALLRTVVIVVSVFIACWSPLFILFLIDVACRVQACPILFKAQWFIVLAVLNSAMNPVIYTLASKEMRRAFFRLVCNCLVRGRGARASPIQPALDPSRSKSSSSNNSSHSPKVKEDLPHTAPSSCIMDKNAALQNGIFCN
UniProt	Q99500
Protein Data Bank	N/A
GPCR-HGmod model	Q99500
3D structure model	This predicted structure model is from GPCR-EXP Q99500.
BioLiP	N/A
Therapeutic Target Database	T11241
ChEMBL	CHEMBL3892
IUPHAR	277
DrugBank	N/A

Ligand

Name	BAS 09529732
Molecular formula	C16H17N3O3
IUPAC name	1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide
Molecular weight	299.33
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	1.2
Synonyms	AC1LM099 SR-01000367787 ST063306 1-(5-Phenyl-isoxazole-3-carbonyl)-piperidine-4-carboxylic acid amide MCULE-1560154433 AKOS000559747 SR-01000367787-1 CHEMBL1565208 ZINC815054 1-[(5-phenylisoxazol-3-yl)carbonyl]piperidine-4-carboxamide MolPort-001-604-588 SR-01000367787-2 1-(5-phenyl-1,2-oxazole-3-carbonyl)piperidine-4-carboxamide HMS1694G02 [ Show all ]
Inchi Key	AZIDAIPMLWSEPN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H17N3O3/c17-15(20)12-6-8-19(9-7-12)16(21)13-10-14(22-18-13)11-4-2-1-3-5-11/h1-5,10,12H,6-9H2,(H2,17,20)
PubChem CID	1093757
ChEMBL	CHEMBL1565208
IUPHAR	N/A
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
EC50	<50000.0 nM	PubChem BioAssay data set	ChEMBL

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