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GLASS

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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	SMR000151229
Molecular formula	C26H32N4O2
IUPAC name	N-[[3-[(2,3-dihydroindole-1-carbonylamino)methyl]cyclohexyl]methyl]-2,3-dihydroindole-1-carboxamide
Molecular weight	432.568
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	4.0
Synonyms	AKOS024390216 MLS002634270 HMS1768B07 N-[[3-[(2,3-dihydroindole-1-carbonylamino)methyl]cyclohexyl]methyl]-2,3-dihydroindole-1-carboxamide 731816-56-1 MCULE-8173305931 Z44602385 MolPort-004-029-970 HMS2395N15 AC1N1MAR MLS000572131 CHEMBL1308130 N-[(3-{[(2,3-dihydro-1H-indole-1-carbonyl)amino]methyl}cyclohexyl)methyl]-2,3-dihydro-1H-indole-1-carboxamide indolinyl-N-({3-[(indolinylcarbonylamino)methyl]cyclohexyl}methyl)carboxamide ST51045344 [ Show all ]
Inchi Key	ADQOQDWLPPQSFQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H32N4O2/c31-25(29-14-12-21-8-1-3-10-23(21)29)27-17-19-6-5-7-20(16-19)18-28-26(32)30-15-13-22-9-2-4-11-24(22)30/h1-4,8-11,19-20H,5-7,12-18H2,(H,27,31)(H,28,32)
PubChem CID	4032625
ChEMBL	CHEMBL1308130
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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