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Target
D(1A) dopamine receptor
Ligand
BDBM160862
Substrate
n/a
Meas. Tech.
Human D1 Receptor Binding Assay
pH
7.4±n/a
Ki
650±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:
BDBM160862
Synonyms:
US10093655, Example 32 | US11014909, Example 32 | US9107923, 32
Type:
Small organic molecule
Emp. Form.:
C21H21FN4O3
Mol. Mass.:
396.4148
SMILES:
Cc1cc(Oc2ncccc2N2CC(F)C2)ccc1-c1c(C)c(=O)[nH]c(=O)n1C |(.53,3.47,;.53,1.93,;-.81,1.15,;-.81,-.38,;-2.14,-1.15,;-2.14,-2.69,;-.81,-3.47,;-.81,-5,;-2.14,-5.78,;-3.48,-5,;-3.48,-3.47,;-4.56,-2.38,;-4.56,-.84,;-6.1,-.84,;-7.19,.25,;-6.1,-2.38,;.53,-1.15,;1.86,-.38,;1.86,1.15,;3.19,1.93,;3.19,3.47,;1.86,4.23,;4.53,4.23,;4.53,5.78,;5.86,3.47,;5.86,1.93,;7.19,1.15,;4.53,1.15,;4.53,-.38,)|
Structure:
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