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GLASS

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

Name	D(1A) dopamine receptor
Species	Bos taurus (Bovine)
Gene	DRD1
Synonym	Dopamine D1 receptor
Disease	N/A for non-human GPCRs
Length	446
Amino acid sequence	MRTLNTSTMEGTGLVAERDFSFRILTACFLSLLILSTLLGNTLVCAAVIRFRHLRSKVTNFFVISLAVSDLLVAVLVMPWKAVAEIAGFWPFGSFCNIWVAFDIMCSTASILNLCVISVDRYWAISSPFRYERKMTPKAAFILISVAWTLSVLISFIPVQLSWHKAKPTGPSEGNATSLGKTINNCDSSLSRTYAISSSLISFYIPVAIMIVTYTRIYRIAQKQIRRISALERAAVHAKNCQTTTGNGNPMECSQPESSFKMSFKRETKVLKTLSVIMGVFVCCWLPFFILNCMVPFCGSGETKPFCIDSITFDVFVWFGWANSSLNPIIYAFNADFRKAFSTLLGCYRLCPTTNNAIETVSINNNGAVVFSSHHEPRGSISKDCNVVYLIPHAVGSSEGLKKEEAVGIAKPLEKLSPALSVILDYDTDVSLEKIQPITQNGQHPT
UniProt	Q95136
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	CHEMBL2967
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	Clebopride
Molecular formula	C20H24ClN3O2
IUPAC name	4-amino-N-(1-benzylpiperidin-4-yl)-5-chloro-2-methoxybenzamide
Molecular weight	373.881
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	3.2
Synonyms	57645-39-3 (mono-hydrochloride) BENZAMIDE, 4-AMINO-5-CHLORO-2-METHOXY-N-(1-(PHENYLMETHYL)-4-PIPERIDINYL)- CHEBI:92309 Clebopride [USAN:INN:BAN] D0A2BE KBio2_007308 N-(1'-benzyl-4'-piperidyl)-2-methoxy-4-amino-5- chlorobenzamide Prestwick0_000380 Spectrum2_000767 4-Amino-N-(1-benzyl-4-piperidyl)-5-chloro-o-anisamide AC1L1EG8 BRN 0493934 Cleboprida Clebopridum EINECS 259-885-9 KBioSS_002172 NCGC00016951-01 Prestwick3_000380 4-amino-5-chloro-2-(methyloxy)-N-[1-(phenylmethyl)piperidin-4-yl]benzamide Spectrum5_001571 4-amino-N-(1-benzylpiperidin-4-yl)-5-chloro- Anti-Secretory Agent C20H24ClN3O2 Clebopride (USAN) Cleboril (TN) KBio2_002172 LAS-9273 NCGC00177974-01 SPBio_002460 4-amino-N-(1-benzyl-4-piperidinyl)-5-chloro-2-methoxybenzamide unspecified maleate of clebopride 905C538 BPBio1_000593 Clebopride [USAN:INN] DivK1c_006848 KBio3_003039 N-(1'-Benzyl-4'-piperidyl)-2-methoxy-4-amino-5-chlorobenzamide Prestwick1_000380 Spectrum3_001997 4-Amino-N-(1-benzyl-piperidin-4-yl)-5-chloro-2-methoxy-benzamide AKOS027420458 BSPBio_000539 Cleboprida [INN-Spanish] Clebopridum [INN-Latin] I0A84520Y9 L000785 NCGC00016951-02 SCHEMBL25710 4-Amino-5-chloro-2-methoxy-N-(1-benzyl-4-piperidyl)benzamide Spectrum_001692 4-amino-N-(1-benzylpiperidin-4-yl)-5-chloro-2-methoxybenzamide 55905-53-8 BDBM50132693 CAS-84370-95-6 clebopride malate D03534 KBio2_004740 LS-25450 NCGC00177974-02 SpecPlus_000752 4-amino-N-(1-benzyl-4-piperidyl)-5-chloro-2-methoxy-benzamide ZINC608261 AB00053707 BRD-K17294426-050-05-7 CHEMBL325109 Clebopride,(S) DTXSID7022831 KBioGR_000346 N-1-benzyl-4 piperidil-3-methoxy-4-amino-5-chlorobenzamide Prestwick2_000380 Spectrum4_000083 4-Amino-N-(1-benzyl-piperidin-4-yl)-5-chloro-2-methoxy-benzamide(Clebopride) 5-22-08-00086 (Beilstein Handbook Reference) AN-40238 BSPBio_003597 Cleboril KBio1_001792 LAS 9273 NCGC00016951-03 SPBio_000814 4-Amino-5-chloro-2-methoxy-N-[1-(phenylmethyl)-4-piperidinyl]benzamide UNII-I0A84520Y9 [ Show all ]
Inchi Key	BVPWJMCABCPUQY-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H24ClN3O2/c1-26-19-12-18(22)17(21)11-16(19)20(25)23-15-7-9-24(10-8-15)13-14-5-3-2-4-6-14/h2-6,11-12,15H,7-10,13,22H2,1H3,(H,23,25)
PubChem CID	2780
ChEMBL	CHEMBL325109
IUPHAR	N/A
BindingDB	50132693
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	6000.0 nM	PMID12951112	BindingDB,ChEMBL

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