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Target
D(1A) dopamine receptor
Ligand
BDBM289111
Substrate
n/a
Meas. Tech.
Human D1 Receptor Binding Assay
pH
7.4±n/a
Ki
12.9±n/a nM
Comments
extracted
Citation
 Brodney, MA; Davoren, JE; Dounay, AB; Efremov, IV; Gray, DL; Green, ME; Henderson, JL; Lee, C; Mente, SR; O Neil, SV; Rogers, BN; Zhang, L Heteroaromatic compounds and their use as dopamine D1 ligands US Patent  US10093655 Publication Date 10/9/2018 
Target
Name:
D(1A) dopamine receptor
Synonyms:
DA D1 receptor | DOPAMINE D1 | DRD1 | DRD1_HUMAN | Dopamine D1 receptor | Dopamine D1 receptor (D1R) | Dopamine D1A
Type:
Enzyme
Mol. Mass.:
49303.43
Organism:
Homo sapiens (Human)
Description:
P21728
Residue:
446
Sequence:
MRTLNTSAMDGTGLVVERDFSVRILTACFLSLLILSTLLGNTLVCAAVIRFRHLRSKVTNFFVISLAVSDLLVAVLVMPWKAVAEIAGFWPFGSFCNIWVAFDIMCSTASILNLCVISVDRYWAISSPFRYERKMTPKAAFILISVAWTLSVLISFIPVQLSWHKAKPTSPSDGNATSLAETIDNCDSSLSRTYAISSSVISFYIPVAIMIVTYTRIYRIAQKQIRRIAALERAAVHAKNCQTTTGNGKPVECSQPESSFKMSFKRETKVLKTLSVIMGVFVCCWLPFFILNCILPFCGSGETQPFCIDSNTFDVFVWFGWANSSLNPIIYAFNADFRKAFSTLLGCYRLCPATNNAIETVSINNNGAAMFSSHHEPRGSISKECNLVYLIPHAVGSSEDLKKEEAAGIARPLEKLSPALSVILDYDTDVSLEKIQPITQNGQHPT
  
Inhibitor
Name:
BDBM289111
Synonyms:
1,5-Dimethyl-6-(7-{[3-(trifluoromethyl)pyridin-2-yl]oxy}-1H-indol-4-yl)pyrimidine-2,4(1H,3H)-dione (19) | US10093655, Example 19
Type:
Small organic molecule
Emp. Form.:
C20H14F3N4O3
Mol. Mass.:
415.3454
SMILES:
Cc1c(-c2ccc(Oc3ncccc3C(F)(F)F)c3[nH]ccc23)n(C)c(=O)nc1=O |(-3.78,12.87,;-2.45,12.1,;-2.45,10.56,;-3.78,9.79,;-3.78,8.25,;-5.12,7.48,;-6.45,8.25,;-7.79,7.48,;-7.79,5.94,;-6.45,5.17,;-6.45,3.63,;-7.79,2.86,;-9.12,3.63,;-9.12,5.17,;-10.45,5.94,;-11.79,5.17,;-10.45,7.48,;-10.45,4.4,;-6.45,9.79,;-7.6,10.82,;-6.97,12.23,;-5.44,12.07,;-5.12,10.56,;-1.12,9.79,;-1.12,8.25,;.22,10.56,;1.55,9.79,;.22,12.1,;-1.12,12.87,;-1.12,14.41,)|
Structure:
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