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GLASS

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GPCR

Name	G-protein coupled bile acid receptor 1
Species	Homo sapiens (Human)
Gene	GPBAR1
Synonym	G-protein coupled receptor GPCR19 TGR5 BG37 G protein-coupled bile acid receptor 1 membrane-type receptor for bile acids M-BAR hGPCR19 hBG37 GPCR19 GPBAR1 GPBA receptor GPR131 [ Show all ]
Disease	Type 2 diabetes Metabolic disorders
Length	330
Amino acid sequence	MTPNSTGEVPSPIPKGALGLSLALASLIITANLLLALGIAWDRRLRSPPAGCFFLSLLLAGLLTGLALPTLPGLWNQSRRGYWSCLLVYLAPNFSFLSLLANLLLVHGERYMAVLRPLQPPGSIRLALLLTWAGPLLFASLPALGWNHWTPGANCSSQAIFPAPYLYLEVYGLLLPAVGAAAFLSVRVLATAHRQLQDICRLERAVCRDEPSALARALTWRQARAQAGAMLLFGLCWGPYVATLLLSVLAYEQRPPLGPGTLLSLLSLGSASAAAVPVAMGLGDQRYTAPWRAAAQRCLQGLWGRASRDSPGPSIAYHPSSQSSVDLDLN
UniProt	Q8TDU6
Protein Data Bank	N/A
GPCR-HGmod model	Q8TDU6
3D structure model	This predicted structure model is from GPCR-EXP Q8TDU6.
BioLiP	N/A
Therapeutic Target Database	T86273
ChEMBL	CHEMBL5409
IUPHAR	37
DrugBank	BE0005788

Ligand

Name	CHEMBL3132972
Molecular formula	C18H16F3N5O2
IUPAC name	5-(3-methoxyphenyl)-N,3-dimethyl-N-[6-(trifluoromethyl)pyridin-3-yl]triazole-4-carboxamide
Molecular weight	391.354
Hydrogen bond acceptor	8
Hydrogen bond donor	0
XlogP	2.5
Synonyms	N/A
Inchi Key	CJPMRCFYMKALED-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H16F3N5O2/c1-25(12-7-8-14(22-10-12)18(19,20)21)17(27)16-15(23-24-26(16)2)11-5-4-6-13(9-11)28-3/h4-10H,1-3H3
PubChem CID	76332905
ChEMBL	CHEMBL3132972
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	135.0 nM	MedChemComm, (2013) 4:1:205	ChEMBL

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