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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Glucagon-like peptide 1 receptor
Species	Homo sapiens (Human)
Gene	GLP1R
Synonym	glucagon-like peptide 1 receptor GLP-1R GLP-1-R GLP-1 receptor
Disease	Type 1/2 diabetes Type 1 diabetes Obesity Non-insulin dependent diabetes Non-alcoholic steatohepatitis Irritable bowel syndrome; Dyspepsia Unspecified Diabetes Brain injury Type 2 diabetes [ Show all ]
Length	463
Amino acid sequence	MAGAPGPLRLALLLLGMVGRAGPRPQGATVSLWETVQKWREYRRQCQRSLTEDPPPATDLFCNRTFDEYACWPDGEPGSFVNVSCPWYLPWASSVPQGHVYRFCTAEGLWLQKDNSSLPWRDLSECEESKRGERSSPEEQLLFLYIIYTVGYALSFSALVIASAILLGFRHLHCTRNYIHLNLFASFILRALSVFIKDAALKWMYSTAAQQHQWDGLLSYQDSLSCRLVFLLMQYCVAANYYWLLVEGVYLYTLLAFSVLSEQWIFRLYVSIGWGVPLLFVVPWGIVKYLYEDEGCWTRNSNMNYWLIIRLPILFAIGVNFLIFVRVICIVVSKLKANLMCKTDIKCRLAKSTLTLIPLLGTHEVIFAFVMDEHARGTLRFIKLFTELSFTSFQGLMVAILYCFVNNEVQLEFRKSWERWRLEHLHIQRDSSMKPLKCPTSSLSSGATAGSSMYTATCQASCS
UniProt	P43220
Protein Data Bank	5vex, 3c59, 3c5t, 5nx2, 3iol, 4zgm, 5otu, 5vew, 5otw, 5otx, 5otv
GPCR-HGmod model	P43220
3D structure model	This structure is from PDB ID 5vex.
BioLiP	BL0418498,BL0418499, BL0143794, BL0143795, BL0167479, BL0167480, BL0324354, BL0324355,BL0324356, BL0378791,BL0378792, BL0379513,BL0379514, BL0418500,BL0418501, BL0380967, BL0418494,BL0418495, BL0418496,BL0418497, BL0143732, BL0143731, BL0380966
Therapeutic Target Database	T36075
ChEMBL	CHEMBL1784
IUPHAR	249
DrugBank	BE0000857

Ligand

Name	2-{1-[(4-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl}-N-(4-methylphenyl)acetamide
Molecular formula	C21H24N4O3S
IUPAC name	2-[1-[(4-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl]-N-(4-methylphenyl)acetamide
Molecular weight	412.508
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	2.0
Synonyms	AKOS002234722 MCULE-6165280057 ZINC01121659 2-(1-{[(4-methoxyphenyl)amino]thioxomethyl}-3-oxopiperazin-2-yl)-N-(4-methylph enyl)acetamide CBKinase1_007337 SMR000200012 CHEMBL1587963 ST50107435 1009547-09-4 AKOS016302211 MLS000581392 2-[1-[(4-methoxyphenyl)carbamothioyl]-3-oxopiperazin-2-yl]-N-(4-methylphenyl)acetamide CBKinase1_019737 SR-01000278588 AC1MG8D9 HMS2563G16 STK167401 2-(1-{[(4-methoxyphenyl)amino]carbonothioyl}-3-oxo-2-piperazinyl)-N-(4-methylphenyl)acetamide BRD-A57762047-001-01-7 MolPort-000-472-795 2-{1-[(4-methoxyanilino)carbothioyl]-3-oxo-2-piperazinyl}-N-(4-methylphenyl)acetamide SR-01000278588-1 [ Show all ]
Inchi Key	AAMWVURKZMHDHP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H24N4O3S/c1-14-3-5-15(6-4-14)23-19(26)13-18-20(27)22-11-12-25(18)21(29)24-16-7-9-17(28-2)10-8-16/h3-10,18H,11-13H2,1-2H3,(H,22,27)(H,23,26)(H,24,29)
PubChem CID	2957105
ChEMBL	CHEMBL1587963
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
Potency	31622.8 nM	PubChem BioAssay data set	ChEMBL

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