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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.
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GPCR

Name	G-protein coupled receptor 182
Species	Homo sapiens (Human)
Gene	GPR182
Synonym	NOW L1-R GPR182 Gpcr22 Gpcr17 adrenomedullin receptor ADMR [ Show all ]
Disease	N/A
Length	404
Amino acid sequence	MSVKPSWGPGPSEGVTAVPTSDLGEIHNWTELLDLFNHTLSECHVELSQSTKRVVLFALYLAMFVVGLVENLLVICVNWRGSGRAGLMNLYILNMAIADLGIVLSLPVWMLEVTLDYTWLWGSFSCRFTHYFYFVNMYSSIFFLVCLSVDRYVTLTSASPSWQRYQHRVRRAMCAGIWVLSAIIPLPEVVHIQLVEGPEPMCLFMAPFETYSTWALAVALSTTILGFLLPFPLITVFNVLTACRLRQPGQPKSRRHCLLLCAYVAVFVMCWLPYHVTLLLLTLHGTHISLHCHLVHLLYFFYDVIDCFSMLHCVINPILYNFLSPHFRGRLLNAVVHYLPKDQTKAGTCASSSSCSTQHSIIITKGDSQPAAAAPHPEPSLSFQAHHLLPNTSPISPTQPLTPS
UniProt	O15218
Protein Data Bank	N/A
GPCR-HGmod model	O15218
3D structure model	This predicted structure model is from GPCR-EXP O15218.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4356
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	NSC697165
Molecular formula	C38H42N8O2
IUPAC name	3-[8-[4-anilino-5-(phenoxymethyl)-1,2,4-triazol-3-yl]octyl]-5-(phenoxymethyl)-N-phenyl-1,2,4-triazol-4-amine
Molecular weight	642.808
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	9.1
Synonyms	NCI60_034634 AC1L97GD CHEMBL194723 3-[8-[4-anilino-5-(phenoxymethyl)-1,2,4-triazol-3-yl]octyl]-5-(phenoxymethyl)-N-phenyl-1,2,4-triazol-4-amine NCIChal_000047 SCHEMBL12168382 CCG-36207 N-(3-(8-(4-Anilino-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl)octyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-4-yl)-N-phenylamine 4H-1,4-Triazol-4-amine, 3,3'-(1,8-octanediyl)bis[5-(phenoxymethyl)-N-phenyl- NSC-697165 [ Show all ]
Inchi Key	WUGBJQZFEUEUFD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C38H42N8O2/c1(3-17-27-35-39-41-37(29-47-33-23-13-7-14-24-33)45(35)43-31-19-9-5-10-20-31)2-4-18-28-36-40-42-38(30-48-34-25-15-8-16-26-34)46(36)44-32-21-11-6-12-22-32/h5-16,19-26,43-44H,1-4,17-18,27-30H2
PubChem CID	394047
ChEMBL	CHEMBL194723
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
Affinity	81.0 %	PMID15943480	ChEMBL

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