Reaction Details Report a problem with these data
Target
D(1A) dopamine receptor
Ligand
BDBM160879
Substrate
n/a
Meas. Tech.
Competition Binding Assay
Ki
288±n/a nM
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  US9107923 Publication Date 8/18/2015 
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:
BDBM160879
Synonyms:
US10093655, Example 49 | US11014909, Example 49 | US9107923, 49
Type:
Small organic molecule
Emp. Form.:
C21H21N3O3
Mol. Mass.:
363.4097
SMILES:
Cc1cc(Oc2ncccc2C2COC2)ccc1-c1c(C)n[nH]c(=O)c1C |(.94,3.47,;.94,1.93,;-.39,1.15,;-.39,-.38,;-1.72,-1.15,;-1.72,-2.69,;-.39,-3.47,;-.39,-5,;-1.72,-5.78,;-3.06,-5,;-3.06,-3.47,;-4.39,-2.69,;-4.79,-1.21,;-6.28,-1.61,;-5.88,-3.09,;.94,-1.15,;2.28,-.38,;2.28,1.15,;3.61,1.93,;4.94,1.15,;4.94,-.38,;6.28,1.93,;6.28,3.47,;4.94,4.23,;4.94,5.78,;3.61,3.47,;2.28,4.23,)|
Structure:
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