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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	Rilmenidine
Molecular formula	C10H16N2O
IUPAC name	N-(dicyclopropylmethyl)-4,5-dihydro-1,3-oxazol-2-amine
Molecular weight	180.251
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	1.2
Synonyms	NCI60_022181 2-((Dicyclopropylmethyl)imino)oxazolidine Prestwick2_000982 AB00514648 S 3341 BDBM50070328 SR-01000002992-4 CCG-205180 ZINC9708 DSSTox_CID_25194 HMS2089G15 LP01104 NCGC00015884-02 NCGC00015884-10 Oxaminozoline 2-Oxazolamine, 4,5-dihydro-N-(dicyclopropylmethyl)- Rilmenidia [Spanish] AC1L2AAM S3341 BSPBio_001043 Tox21_110254 CHEMBL289480 DTXSID3045194 Hyperium (TN) N-(Dicyclopropylmethyl)-4,5-dihydro-1,3-oxazol-2-amine NCGC00015884-05 NCGC00021689-02 NCGC00021689-06 187R041 Prestwick0_000982 54187-04-1 Rilmenidine [INN] AN-40635 SR-01000002992 C11120 UNII-P67IM25ID8 FCH842460 Lopac-R-134 N-(Dicyclopropylmethyl)-N-(4,5-dihydro-1,3-oxazol-2-yl)amine NCGC00015884-08 NSC-664312 2-(dicyclopropylmethylamino) oxazoline Prestwick3_000982 AB07513 S-3341 BPBio1_001149 Tenaxum;HYPERIUM CHEBI:8862 DSSTox_GSID_45194 HMS3263M10 LS-100036 NCGC00015884-03 NCGC00015884-11 Oxazolidine, 2-((dicyclopropylmethyl)imino)- 2-Oxazolamine, N-(dicyclopropylmethyl)-4,5-dihydro- AC1Q4UHN SCHEMBL114420 C-06746 Tox21_110254_1 CQXADFVORZEARL-UHFFFAOYSA-N EINECS 259-021-0 I14-6505 N-(Dicyclopropylmethyl)-4,5-dihydro-2-oxazolamine; NCGC00015884-06 NCGC00021689-04 NCGC00261789-01 2-((Dicyclopropylmethyl)amino)-2-oxazoline Prestwick1_000982 AB00513728-09 Rilmenidinum [Latin] BC220360 SR-01000002992-3 CAS-54187-04-1 W-105661 DB11738 FT-0630668 Lopac0_001104 NCGC00015884-01 NCGC00015884-09 NSC664312 2-(Dicyclopropylmethylamino)-2-oxazoline R-134 AB2000100 S-3341-3 BRN 1211287 Tocris-0790 DSSTox_RID_80741 Hyperium Methylamine, 1,1-dicyclopropyl-N-(2-oxazolinyl)- NCGC00015884-04 NCGC00015884-13 (N-dicyclopropylmethyl)-amino-2-oxazoline P67IM25ID8 Rilmenidine (INN) AKOS006273431 SPBio_002944 C10H16N2O Tox21_501104 D08482 EU-0101104 L001230 N-(Dicyclopropylmethyl)-4,5-dihydrooxazol-2-amine NCGC00015884-07 NCGC00021689-05 [ Show all ]
Inchi Key	CQXADFVORZEARL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C10H16N2O/c1-2-7(1)9(8-3-4-8)12-10-11-5-6-13-10/h7-9H,1-6H2,(H,11,12)
PubChem CID	68712
ChEMBL	CHEMBL289480
IUPHAR	N/A
BindingDB	50070328
DrugBank	DB11738
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Potency	183.6 nM	PubChem BioAssay data set	ChEMBL

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