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GLASS

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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	UNII-7W7511NPF8
Molecular formula	C20H20N2O3S
IUPAC name	1-[[4-(1,3-benzothiazol-2-yloxy)phenyl]methyl]piperidine-4-carboxylic acid
Molecular weight	368.451
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	1.8
Synonyms	Piperidine-4-carboxylic acid, 1-(4-(benzothiazol-2-yloxy)benzyl)- AKOS032948037 1-[4-(Benzothiazol-2-yloxy)benzyl]piperidine-4-carboxylic Acid BGW JNJ 26993135 7W7511NPF8 SCHEMBL1896239 1-(4-(benzothiazol-2-yloxy)benzyl)piperidine-4-carboxylic acid BDBM24239 1-[[4-(1,3-benzothiazol-2-yloxy)phenyl]methyl]piperidine-4-carboxylic acid JNJ-26993135 841202-16-2 1-(4-(benzo[d]thiazol-2-yloxy)benzyl)piperidine-4-carboxylic acid Benzthiazole compound, 33r CHEMBL481280 1-{[4-(1,3-benzothiazol-2-yloxy)phenyl]methyl}piperidine-4-carboxylic acid [ Show all ]
Inchi Key	BUZBVOKDNAZIIM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H20N2O3S/c23-19(24)15-9-11-22(12-10-15)13-14-5-7-16(8-6-14)25-20-21-17-3-1-2-4-18(17)26-20/h1-8,15H,9-13H2,(H,23,24)
PubChem CID	11245596
ChEMBL	CHEMBL481280
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
Inhibition	>10.0 %	PMID18588282	ChEMBL

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