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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	Histamine H2 receptor
Species	Cavia porcellus (Guinea pig)
Gene	HRH2
Synonym	Gastric receptor I H2R HH2R
Disease	N/A for non-human GPCRs
Length	359
Amino acid sequence	MAFNGTVPSFCMDFTVYKVTISVILIILILVTVAGNVVVCLAVGLNRRLRSLTNCFIVSLAVTDLLLGLLVLPFSAIYQLSCKWSFSKVFCNIYTSLDVMLCTASILNLFMISLDRYCAVTDPLRYPVLITPARVAISLVFIWVISITLSFLSIHLGWNSRNETSKDNDTIVKCKVQVNEVYGLVDGLVTFYLPLLIMCITYFRIFKIAREQARRINHIGSWKAATIREHKATVTLAAVMGAFIICWFPYFTVFVYRGLKGDDAVNEVFEDVVLWLGYANSALNPILYAALNRDFRTAYHQLFCCRLASHNSHETSLRLNNSQLNRSQCQEPRWQEDKPLNLQVWSGTEVTAPQGATNR
UniProt	P47747
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2882
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	METIAMIDE
Molecular formula	C9H16N4S2
IUPAC name	1-methyl-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]thiourea
Molecular weight	244.375
Hydrogen bond acceptor	3
Hydrogen bond donor	3
XlogP	0.5
Synonyms	D0W9LJ KB-219225 Metiamide (USAN/INN) N-Methyl-N'-(2-(((5-methylimidazol-4-yl)methyl)thio)ethyl)thiourea N-methyl-N'-[2-((5-methyl-4-imidazolyl)methylthio)ethyl]-thiourea NSC_1548992 1-Methyl-3-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)thiourea SK&F-92058 34839-70-8 AE-641/30115027 C07449 CHEBI:6896 DTXSID80188390 MCULE-4285442691 Metiamide [USAN:INN:BAN] N-methyl-N'-[2-((4-methyl-5-imidazolyl)methylthio)-ethyl]thiourea N-methyl-N'-[2-(5-methylimidazol-4-yl)methylthioethyl] thiourea RL03297 1-Methyl-3-[2-[[(5-methyl-1H-imidazol-4-yl)methyl]thio]ethyl]thiourea;1-methyl-3-(2-((5-methyl-1H-imidazol-4-yl)methylthio)ethyl)thiourea Thiourea, N-methyl-N'-[2-[[(5-methyl-1H-imidazol-4-yl)methyl]thio]ethyl]- 4CA-0813 API0007627 CS-1294 HY-15540 Metiamida [INN-Spanish] MolPort-002-801-395 N-methyl-N'-[2-((4-methyl-5-imidazolyl)methylthio)ethyl]thiourea NSC-307755 SCHEMBL534307 3-Methyl-1-(2-((5-methyl-4-imidazolyl)methylthio)ethyl)thiourea W-5324 AC1LU7MD BDBM50000382 L023988 Metiamide HCl N-Methyl-N'-(2-([(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl)ethyl)thiourea # N-methyl-N'-[2-((5-methyl-4-imidazolyl)methylthio)ethyl]thiourea PDSP1_000614 1-Methyl-3-(2-(((5-methylimidazol-4-yl)methyl)thio)ethyl)-2-thiourea SKF 92058 3K7670861M AJ-54031 C9H16N4S2 FPBPLBWLMYGIQR-UHFFFAOYSA-N Methiamide Metiamidum N-methyl-N'-[2-((4-methyl-5-imidazolyl)methylthio)ethyl] thiourea N-Methyl-N'-[2-[[(5-methylimidazol-4-yl)methyl]thio]ethyl]thiourea SC-94342 1-Methyl-3-[2-[[(5-methylimidazol-4-yl)methyl]thio]ethyl]-2-thiourea UNII-3K7670861M AX8140020 D05004 J-522704 MolPort-018-684-840 N-methyl-N'-[2-((5-methyl-4-imidazolyl)-methylthio)ethyl]thiourea NSC307755 SK&F 92058 3-methyl-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]thiourea ZINC5424950 ACM34839708 BDBM81468 CAS_34839-70-8 DB08805 LS-160472 Metiamide [USAN:BAN:INN] N-methyl-N'-(2-{[(4-methyl-1H-imidazol-5-yl)methyl]sulfanyl}ethyl)thiourea N-methyl-N'-[2-(5-methyl-4-imidazolylmethylthio)ethyl]thiourea PDSP2_000611 1-methyl-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]thiourea Thiourea, N-methyl-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)- 4243AB AKOS005065704 CHEMBL275446 GTPL1233 Metiamida Metiamidum [INN-Latin] N-methyl-N'-[2-((4-methyl-5-imidazolyl)methylthio)ethyl]-thiourea NSC 307755 SCHEMBL11363901 Urea, 1-methyl-3-(2-(((5-methylimidazol-4-yl)methyl)thio)ethyl)-2-thio- BCP21503 [ Show all ]
Inchi Key	FPBPLBWLMYGIQR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C9H16N4S2/c1-7-8(13-6-12-7)5-15-4-3-11-9(14)10-2/h6H,3-5H2,1-2H3,(H,12,13)(H2,10,11,14)
PubChem CID	1548992
ChEMBL	CHEMBL275446
IUPHAR	1233
BindingDB	50000382, 81468
DrugBank	DB08805
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
-Log KB	6.04 -	PMID3941412	ChEMBL
KB	9.2e-07 -	PMID1967317	ChEMBL
Kb	920.0 nM	PMID17751	ChEMBL
Ki	510.0 nM	PMID6135157	PDSP,BindingDB
Ratio	0.003 -	PMID423213	ChEMBL

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