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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	MLS000106678
Molecular formula	C11H12N2OS
IUPAC name	4-methoxy-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
Molecular weight	220.29
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	3.1
Synonyms	cid_717679 MolPort-000-703-649 3-methoxy-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2,4,6-tetraene 4-methoxy-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine BAS 06105288 HMS3437C05 SR-01000392419-1 4-methoxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine MCULE-4901961585 Z31131451 AC1LETCG F0239-0404 SMR000111055 4-Methoxy-5,6,7,8-tetrahydro-benzo[4,5]thieno[2,3-d]pyrimidine 4-methoxy-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidine BDBM49117 HMS552F05 ST50023196 40277-31-4 CHEMBL1423515 ZINC116423 AKOS000281631 HMS2449E06 SR-01000392419 4-methoxy-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine 4-methoxy-5,6,7,8-tetrahydrobenzo[b]thiopheno[2,3-d]pyrimidine CCG-240383 Maybridge1_003811 STK394315 [ Show all ]
Inchi Key	APMNRWQWJSNFBB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C11H12N2OS/c1-14-10-9-7-4-2-3-5-8(7)15-11(9)13-6-12-10/h6H,2-5H2,1H3
PubChem CID	717679
ChEMBL	CHEMBL1423515
IUPHAR	N/A
BindingDB	49117
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	0.00401 nM	N/A	BindingDB

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