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GLASS

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

Name	Histamine H2 receptor
Species	Homo sapiens (Human)
Gene	HRH2
Synonym	HH2R H2R Gastric receptor I H2 receptor
Disease	Ulcerative colitis Pain Peptic ulcer Gastroesophageal reflux disease Gastric ulcer Gastric secretory disorders Stomach ulcer Duodenal ulcers Acid-reflux disorders [ Show all ]
Length	359
Amino acid sequence	MAPNGTASSFCLDSTACKITITVVLAVLILITVAGNVVVCLAVGLNRRLRNLTNCFIVSLAITDLLLGLLVLPFSAIYQLSCKWSFGKVFCNIYTSLDVMLCTASILNLFMISLDRYCAVMDPLRYPVLVTPVRVAISLVLIWVISITLSFLSIHLGWNSRNETSKGNHTTSKCKVQVNEVYGLVDGLVTFYLPLLIMCITYYRIFKVARDQAKRINHISSWKAATIREHKATVTLAAVMGAFIICWFPYFTAFVYRGLRGDDAINEVLEAIVLWLGYANSALNPILYAALNRDFRTGYQQLFCCRLANRNSHKTSLRSNASQLSRTQSREPRQQEEKPLKLQVWSGTEVTAPQGATDR
UniProt	P25021
Protein Data Bank	N/A
GPCR-HGmod model	P25021
3D structure model	This predicted structure model is from GPCR-EXP P25021.
BioLiP	N/A
Therapeutic Target Database	T30985
ChEMBL	CHEMBL1941
IUPHAR	263
DrugBank	BE0000112

Ligand

Name	CHEMBL1078735
Molecular formula	C19H23N7
IUPAC name	1-cyano-2-[4-(1H-imidazol-5-yl)butyl]-3-[2-(1H-indol-3-yl)ethyl]guanidine
Molecular weight	349.442
Hydrogen bond acceptor	3
Hydrogen bond donor	4
XlogP	2.5
Synonyms	N/A
Inchi Key	BMCMMMRTWLCMFW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H23N7/c20-13-25-19(22-9-4-3-5-16-12-21-14-26-16)23-10-8-15-11-24-18-7-2-1-6-17(15)18/h1-2,6-7,11-12,14,24H,3-5,8-10H2,(H,21,26)(H2,22,23,25)
PubChem CID	44482297
ChEMBL	CHEMBL1078735
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
pKb	>5.0 -	PMID19791743	ChEMBL

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