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GLASS

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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	SKF-75670
Molecular formula	C17H19NO2
IUPAC name	3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol
Molecular weight	269.344
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	3.0
Synonyms	3-Methyl-1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7,8-diol; hydrochloride NCGC00162337-01 GTPL936 Skf 75670 2,3,4,5-Tetrahydro-3-methyl-1-phenyl-1H-3-benzazepine-7,8-diol CAS_173870 NCGC00015942-02 3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol CHEMBL1193571 NSC_173870 AC1L5AM7 L000564 3-methyl-1-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol CCG-205164 NCGC00015942-03 D0V4FZ SCHEMBL11712694 BDBM81986 Lopac0_001087 [ Show all ]
Inchi Key	LIHCKGZEDBNUJG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H19NO2/c1-18-8-7-13-9-16(19)17(20)10-14(13)15(11-18)12-5-3-2-4-6-12/h2-6,9-10,15,19-20H,7-8,11H2,1H3
PubChem CID	173871
ChEMBL	CHEMBL1193571
IUPHAR	936
BindingDB	81986
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	8.8 nM	PMID1684995	BindingDB
Potency	9.2 nM	PubChem BioAssay data set	ChEMBL
Potency	51.7 nM	PubChem BioAssay data set	ChEMBL
Potency	79.4 nM	PubChem BioAssay data set	ChEMBL

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