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Name | D(1A) dopamine receptor |
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Species | Homo sapiens (Human) |
Gene | DRD1 |
Synonym | D1 receptor D1A DADR Gpcr15 dopamine D1 receptor [ Show all ] |
Disease | Unspecified Hypertension Pain Parkinson's disease Psychiatric disorder [ 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 |
Name | LE 300 |
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Molecular formula | C20H22N2 |
IUPAC name | 11-methyl-11,21-diazatetracyclo[12.7.0.03,8.015,20]henicosa-1(14),3,5,7,15,17,19-heptaene |
Molecular weight | 290.41 |
Hydrogen bond acceptor | 1 |
Hydrogen bond donor | 1 |
XlogP | 4.3 |
Synonyms | 11-methyl-11,21-diazatetracyclo[12.7.0.0^{3,8}.0^{15,20}]henicosa-1(14),3(8),4,6,15,17,19-heptaene 7-methyl-6,7,8,9,14,15-hexahydro-5H-indolo[3,2-f][3]benzazecine BRD-K01648091-001-01-8 DTXSID20402244 NCGC00015614-01 [ Show all ] |
Inchi Key | YEWGIGCYIAMFMA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H22N2/c1-22-12-10-15-6-2-3-7-16(15)14-20-18(11-13-22)17-8-4-5-9-19(17)21-20/h2-9,21H,10-14H2,1H3 |
PubChem CID | 4350931 |
ChEMBL | CHEMBL441618 |
IUPHAR | N/A |
BindingDB | 50088341 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 1.86 nM | PMID18534847 | BindingDB |
Ki | 1.862 nM | PMID18534847 | ChEMBL |
Ki | 1.9 nM | PMID17034146, MedChemComm, (2015) 6:9:1679, PMID16539400, PMID17188870 | BindingDB,ChEMBL |
Ki | >10.0 nM | PMID24900831 | ChEMBL |
Ki | >10.0 nM | PMID24900831 | BindingDB |
Ki | 60.4 nM | PMID17034146, PMID16539400 | BindingDB,ChEMBL |
Potency | 29.1 nM | PubChem BioAssay data set | ChEMBL |
Potency | 354.8 nM | PubChem BioAssay data set | ChEMBL |
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