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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	Orexin receptor type 2
Species	Homo sapiens (Human)
Gene	HCRTR2
Synonym	Ox-2-R OX2 receptor Ox2-R OX2R orexin receptor type 2 Hypocretin receptor type 2 hypocretin receptor 2 hypocretin (orexin) receptor 2 [ Show all ]
Disease	Insomnia
Length	444
Amino acid sequence	MSGTKLEDSPPCRNWSSASELNETQEPFLNPTDYDDEEFLRYLWREYLHPKEYEWVLIAGYIIVFVVALIGNVLVCVAVWKNHHMRTVTNYFIVNLSLADVLVTITCLPATLVVDITETWFFGQSLCKVIPYLQTVSVSVSVLTLSCIALDRWYAICHPLMFKSTAKRARNSIVIIWIVSCIIMIPQAIVMECSTVFPGLANKTTLFTVCDERWGGEIYPKMYHICFFLVTYMAPLCLMVLAYLQIFRKLWCRQIPGTSSVVQRKWKPLQPVSQPRGPGQPTKSRMSAVAAEIKQIRARRKTARMLMIVLLVFAICYLPISILNVLKRVFGMFAHTEDRETVYAWFTFSHWLVYANSAANPIIYNFLSGKFREEFKAAFSCCCLGVHHRQEDRLTRGRTSTESRKSLTTQISNFDNISKLSEQVVLTSISTLPAANGAGPLQNW
UniProt	O43614
Protein Data Bank	5ws3, 5wqc, 4s0v, 4rnb
GPCR-HGmod model	O43614
3D structure model	This structure is from PDB ID 5ws3.
BioLiP	BL0303710, BL0398950, BL0397818, BL0302679
Therapeutic Target Database	T69485
ChEMBL	CHEMBL4792
IUPHAR	322
DrugBank	BE0005865

Ligand

Name	CHEMBL3622428
Molecular formula	C32H34N4O6S
IUPAC name	3-[4-methoxy-3-[[3-[2-[(3-methoxybenzoyl)amino]ethylamino]phenyl]sulfamoyl]phenyl]-N,N-dimethylbenzamide
Molecular weight	602.706
Hydrogen bond acceptor	8
Hydrogen bond donor	3
XlogP	4.4
Synonyms	N-(2-(3-(4-Methoxy-3'-dimethylcarbamoyl-3-biphenylylsulfonylamino)anilino)ethyl)-3-methoxybenzamide SCHEMBL18138768 BDBM50121307
Inchi Key	AINDCHPKOIXBSO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C32H34N4O6S/c1-36(2)32(38)25-10-5-8-22(18-25)23-14-15-29(42-4)30(20-23)43(39,40)35-27-12-7-11-26(21-27)33-16-17-34-31(37)24-9-6-13-28(19-24)41-3/h5-15,18-21,33,35H,16-17H2,1-4H3,(H,34,37)
PubChem CID	122191829
ChEMBL	CHEMBL3622428
IUPHAR	N/A
BindingDB	50121307
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
EC50	33.0 nM	PMID26267383	BindingDB,ChEMBL
Emax	54.0 %	PMID26267383	ChEMBL

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