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GPCR

Name	5-hydroxytryptamine receptor 4
Species	Cavia porcellus (Guinea pig)
Gene	HTR4
Synonym	5-HT-4 5-HT4 Serotonin receptor 4
Disease	N/A for non-human GPCRs
Length	388
Amino acid sequence	MDKLDANVSSKEGFGSVEKVVLLTFLSAVILMAILGNLLVMVAVCRDRQLRKIKTNYFIVSLAFADLLVSVLVMPFGAIELVQDIWVYGEMFCLVRTSLDVLLTTASIFHLCCISLDRYYAICCQPLVYRNKMTPLRIALMLGGCWVIPMFISFLPIMQGWNNIGIVDLIEKRKFNQNSNSTYCVFMVNKPYAITCSVVAFYIPFLLMVLAYYRIYVTAKEHARQIQVLQRAGAPAEGRPQPADQHSTHRMRTETKAAKTLCIIMGCFCLCWAPFFVTNIVDPFIDYTVPGQLWTAFLWLGYINSGLNPFLYAFLNKSFRRAFLIILCCDDERYRRPSILGQTVPCSTTTINGSTHVLRDTVECGGQWESQCHPAASSPLVAAQPIDT
UniProt	O70528
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	CHEMBL5017
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	metoclopramide
Molecular formula	C14H22ClN3O2
IUPAC name	4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide
Molecular weight	299.799
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	2.6
Synonyms	Paspertin Pramin Pylomid (TN) SBI-0050740.P004 Spectrum5_001449 Metoclopramide (JP15/INN) Tox21_110188_1 Metoclopramidum [INN-Latin] n-Anisamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)- NCGC00015643-08 NINDS_000069 364M625 Emetid 4-Amino-5-chloro-N-(2-diethylamino-ethyl)-2-methoxy-benzamide (metoclopramide) Gastromax 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide;hydrochloride HSDB 7841 AB00053498_14 KBio2_004686 ARONIS24307 KS-5055 bmse000779 Maxolon BSPBio_002027 Metadrate CTK8G1095 2-methoxy-4-amino-5-chloro-N,N-(dimethylaminoethyl)benzamide DSSTox_CID_25169 o-Anisamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)- (8CI) Plasil Prestwick2_000209 Reglan SPBio_001740 ST077151 Metoclopramide Omega US9132134, Metoclopramide MolPort-000-883-854 NCGC00015643-03 NCGC00015643-13 4-Amino-5-chloro-2-methoxy-N-(beta-diethylaminoethyl)benzamide Eucil 4-amino-5-chloro-N-[2-(diethylamino)-ethyl]-2-methoxybenzamide Gastrotablinen 5-Chloro-2-methoxyprocainamide Imperan AJ-26684 KBioGR_001307 Benzamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxy- (9CI) Lopac-M-0763 BRD-K75641298-001-01-5 MCULE-8566255889 CAS-364-62-5 Methoclopramide Clopra 2-Methoxy-5-chloroprocainamide DTXSID6045169 Octamide Pramidin Primperan (tablet) (Salt/Mix) Reliveran Spectrum3_000504 Metoclopramida [INN-Spanish] Terperan (TN) Metoclopramide, VETRANAL(TM), analytical standard N-(2-diethylaminoethyl)-2-methoxy-4-amino-5-chlorobenzamide NCGC00015643-06 NCI60_003185 Elieten 4-Amino-5-chloro-N-(2-diethylamino-ethyl)-2-methoxy-benzamide Gastro-Timelets 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide GTPL241 AB00053498 KBio1_000069 AN-44542 KS-00000GNS Benzamide,4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxy- Maxeran BRN 1884366 Metaclopramide Cerucal Metochloropramide Clopromate (metoclopramide)4-Amino-5-chloro-N-(2-diethylamino-ethyl)-2-methoxy-benzamide DEL 1267 2576-84-3 (di-hydrochloride) Paspertin (Salt/Mix) Prestwick0_000209 Reclomide SC-81367 Spectrum_001638 Metoclopramide (JP17/INN) TTWJBBZEZQICBI-UHFFFAOYSA-N Metocobil NCGC00015643-01 NCGC00015643-09 Nu-Metoclopramide 4 Amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide Emitasol 4-Amino-5-chloro-N-(2-diethylamino-ethyl)-2-methoxy-benzamide(Metoclopramide) Gastronerton 4-azanyl-5-chloranyl-N-[2-(diethylamino)ethyl]-2-methoxy-benzamide;hydrochloride HY-17382 AB1009457 KBio2_007254 BDBM48320 L001078 BPBio1_000217 Maxolon (Salt/Mix) C07868 Metamide CHEMBL86 D00726 2-Methoxy-4-amino-5-chloro-N,N-dimethylaminoethyl)benzamide DSSTox_GSID_45169 O-Anisamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-(8CI) Plasil (pharmaceutical) Prestwick3_000209 Reglan (Salt/Mix) SPBio_002118 Metoclol STL257058 Metoclopramide [INN:BAN:JAN] Z2196779550 Moriperan NCGC00015643-04 NCGC00024440-03 Duraclamid 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide FT-0628931 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxy-benzamide Gastrotem 54143-57-6 (mono-hydrochloride, mono-hydrate) J90028 AK468880 KBioSS_002118 Benzamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxy-(9CI) Lopac0_000762 BRD-K75641298-003-05-2 Meclopran CAS-7232-21-5 Methoxychlorprocainamide CLOPRA-"YELLOW" (4-amino-5-chloro-2-methoxyphenyl)-N-[2-(diethylamino)ethyl]carboxamide DB01233 232M215 Parmid Pramiel Primperan (TN) SBB037841 Spectrum4_000964 Tox21_110188 Metoclopramidum N-(Diethylaminoethyl)-2-methoxy-4-amino-5-chlorobenzamide NCGC00015643-07 Neu-Sensamide Elieten (TN) 4-Amino-5-chloro-N-(2-diethylamino-ethyl)-2-methoxy-benzamide (Mcp) Gastrobid 4-Amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide; Methoxychloroprocainamide HMS2089G16 AB00053498-13 KBio2_002118 Apo-Metoclop KS-000048I1 Biomol-NT_000082 Maxeran (TN) BSPBio_000197 Metaclopromide CHEBI:107736 CS-1064 DivK1c_000069 364-62-5 o-Anisamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)- Peraprin Prestwick1_000209 Regla SCHEMBL18629 ST024773 Metoclopramide Monohydrochloride, Monohydrate UNII-L4YEB44I46 Metramid NCGC00015643-02 NCGC00015643-11 4-Amino-5-chloro-2-methoxy-N-(.beta.-diethylaminoethyl)benzamide Emperal 4-amino-5-chloro-N-(2-diethylaminoethyl)-2-methoxybenzamide Gastrosil IDI1_000069 AC1L1HKD KBio3_001527 Benzamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxy- L4YEB44I46 BPBio1_001100 Maxolon (TN) C14H22ClN3O2 Methochlopramide cid_23659 D08VYV 2-Methoxy-4-amino-5-chloro-N,N-dimethylaminoethylbenzamide DSSTox_RID_80719 o-Anisamide, 4-amino-5-chloro-N-[2-(diethylamino)ethyl]- Pms-Metoclopramide Primperan Reglan (TN) Spectrum2_001720 Metoclopramida Terperan Metoclopramide, European Pharmacopoeia (EP) Reference Standard ZINC1530716 Mygdalon NCGC00015643-05 NCGC00024440-04 EINECS 206-662-9 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-o-anisamide Gastrese 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxy-benzamide;hydrochloride Gimoli 7232-21-5 (mono-hydrochloride) KB-189202 AKOS000280832 KM1470 Benzamide, 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxy- LS-20038 BRD-K75641298-003-16-9 Megaldrate CCG-204847 Metochlopramide Clopra-Yellow (metaclopramide)4-Amino-5-chloro-N-(2-diethylamino-ethyl)-2-methoxy-benzamide Degan (TN) [ Show all ]
Inchi Key	TTWJBBZEZQICBI-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)
PubChem CID	4168
ChEMBL	CHEMBL86
IUPHAR	241
BindingDB	48320
DrugBank	DB01233
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC20	120.0 ng ml-1	PMID8459397	ChEMBL
EC50	5.7 nM	PMID9046352	BindingDB,ChEMBL
IC50	912.0 nM	PMID12593651	BindingDB,ChEMBL
Intrinsic activity	1.0 -	PMID7608898	ChEMBL
Ki	501.18 nM	PMID7984267, PMID8358562	PDSP,BindingDB
Ki	546.0 nM	PMID12593651	BindingDB,ChEMBL
Ki	630.95 nM	PMID7984267, PMID8358562	PDSP,BindingDB
pD2	5.5 -	Bioorg. Med. Chem. Lett., (1992) 2:5:461	ChEMBL
pD2	5.6 -	PMID7608898	ChEMBL

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