Reaction Details Report a problem with these data
Target
D(1A) dopamine receptor
Ligand
BDBM160869
Substrate
n/a
Meas. Tech.
Receptor Binding Assay
Ki
15.0±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  US11014909 Publication Date 5/25/2021 
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:
BDBM160869
Synonyms:
US10093655, Example 39 | US11014909, Example 39 | US9107923, 39
Type:
Small organic molecule
Emp. Form.:
C21H21N3O3
Mol. Mass.:
363.4097
SMILES:
Cc1cc(Oc2cc(ccn2)C2CC2)ccc1-c1c(C)c(=O)[nH]c(=O)n1C |(.1,4.13,;.1,2.59,;-1.23,1.82,;-1.23,.28,;-2.56,-.49,;-2.56,-2.03,;-3.9,-2.8,;-3.9,-4.34,;-2.56,-5.11,;-1.23,-4.34,;-1.23,-2.8,;-5.23,-5.11,;-6.77,-5.11,;-6,-6.44,;.1,-.49,;1.44,.28,;1.44,1.82,;2.77,2.59,;2.77,4.13,;1.44,4.9,;4.1,4.9,;4.1,6.44,;5.44,4.13,;5.44,2.59,;6.77,1.82,;4.1,1.82,;4.1,.28,)|
Structure:
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