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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	Homo sapiens (Human)
Gene	DRD1
Synonym	D1 receptor D1A DADR Gpcr15 dopamine D1 receptor Dopamine-1A receptor [ Show all ]
Disease	Unspecified Hypertension Pain Parkinson's disease Psychiatric disorder Psychotic disorders Schizophrenia Substance dependence Type 2 diabetes Excessive bleeding following childbirth and spontaneous or elective abortion Cocaine addiction Dementia Cognitive disorders [ Show all ]
Length	446
Amino acid sequence	MRTLNTSAMDGTGLVVERDFSVRILTACFLSLLILSTLLGNTLVCAAVIRFRHLRSKVTNFFVISLAVSDLLVAVLVMPWKAVAEIAGFWPFGSFCNIWVAFDIMCSTASILNLCVISVDRYWAISSPFRYERKMTPKAAFILISVAWTLSVLISFIPVQLSWHKAKPTSPSDGNATSLAETIDNCDSSLSRTYAISSSVISFYIPVAIMIVTYTRIYRIAQKQIRRIAALERAAVHAKNCQTTTGNGKPVECSQPESSFKMSFKRETKVLKTLSVIMGVFVCCWLPFFILNCILPFCGSGETQPFCIDSNTFDVFVWFGWANSSLNPIIYAFNADFRKAFSTLLGCYRLCPATNNAIETVSINNNGAAMFSSHHEPRGSISKECNLVYLIPHAVGSSEDLKKEEAAGIARPLEKLSPALSVILDYDTDVSLEKIQPITQNGQHPT
UniProt	P21728
Protein Data Bank	N/A
GPCR-HGmod model	P21728
3D structure model	This predicted structure model is from GPCR-EXP P21728.
BioLiP	N/A
Therapeutic Target Database	T22118
ChEMBL	CHEMBL2056
IUPHAR	214
DrugBank	BE0000020

Ligand

Name	CHEMBL201177
Molecular formula	C21H24N2
IUPAC name	3-methyl-7-phenyl-2,4,5,6,7,8-hexahydro-1H-azonino[5,4-b]indole
Molecular weight	304.437
Hydrogen bond acceptor	1
Hydrogen bond donor	1
XlogP	4.6
Synonyms	AKOS016035476 BDBM50180907 1,2,3,4,5,6,7,8-Octahydro-3-methyl-7-phenylazonino[5,4-b]indole SCHEMBL11823184 AEHACZVHKAVVDK-UHFFFAOYSA-N 3-methyl-7-phenyl-1,2,3,4,5,6,7,8-octahydroazonino[5,4-b]indole [ Show all ]
Inchi Key	AEHACZVHKAVVDK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H24N2/c1-23-14-7-11-17(16-8-3-2-4-9-16)21-19(13-15-23)18-10-5-6-12-20(18)22-21/h2-6,8-10,12,17,22H,7,11,13-15H2,1H3
PubChem CID	21555004
ChEMBL	CHEMBL201177
IUPHAR	N/A
BindingDB	50180907
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	<10000.0 nM	PMID16420061	BindingDB,ChEMBL

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