Reaction Details Report a problem with these data
Target
D(3) dopamine receptor
Ligand
BDBM593740
Substrate
n/a
Meas. Tech.
Binding Inhibition for Dopamine D3 Receptor
Ki
0.110±n/a nM
Citation
 Tobinaga, H; Masuda, K Condensed ring compounds having dopamine D3 receptor antagonistic effect US Patent  US11578084 Publication Date 2/14/2023 
Target
Name:
D(3) dopamine receptor
Synonyms:
DRD3 | DRD3_HUMAN | Dopamine D3 receptor
Type:
PROTEIN
Mol. Mass.:
44213.40
Organism:
Homo sapiens
Description:
ChEMBL_105671
Residue:
400
Sequence:
MASLSQLSGHLNYTCGAENSTGASQARPHAYYALSYCALILAIVFGNGLVCMAVLKERALQTTTNYLVVSLAVADLLVATLVMPWVVYLEVTGGVWNFSRICCDVFVTLDVMMCTASILNLCAISIDRYTAVVMPVHYQHGTGQSSCRRVALMITAVWVLAFAVSCPLLFGFNTTGDPTVCSISNPDFVIYSSVVSFYLPFGVTVLVYARIYVVLKQRRRKRILTRQNSQCNSVRPGFPQQTLSPDPAHLELKRYYSICQDTALGGPGFQERGGELKREEKTRNSLSPTIAPKLSLEVRKLSNGRLSTSLKLGPLQPRGVPLREKKATQMVAIVLGAFIVCWLPFFLTHVLNTHCQTCHVSPELYSATTWLGYVNSALNPVIYTTFNIEFRKAFLKILSC
  
Inhibitor
Name:
BDBM593740
Synonyms:
US11578084, Compound I-023
Type:
Small organic molecule
Emp. Form.:
C24H34F2N6O2S
Mol. Mass.:
508.628
SMILES:
Cn1ncc(CC(=O)N[C@H]2CC[C@H](CCN3CCc4nc(OC5CC(F)(F)C5)sc4CC3)CC2)n1 |r,wU:12.12,wD:9.8,(13.59,1.63,;12.05,1.63,;11.15,.39,;9.68,.86,;9.68,2.4,;8.35,3.17,;7.01,2.4,;7.01,.86,;5.68,3.17,;4.35,2.4,;3.01,3.17,;1.68,2.4,;1.68,.86,;.34,.09,;-.99,.86,;-2.32,.09,;-3.53,1.05,;-5.03,.71,;-5.7,-.68,;-7.22,-.89,;-7.5,-2.4,;-8.83,-3.17,;-10.16,-2.4,;-10.56,-.91,;-12.05,-1.31,;-13.59,-1.31,;-12.82,.02,;-11.65,-2.8,;-6.14,-3.13,;-5.03,-2.07,;-3.53,-2.41,;-2.32,-1.45,;3.01,.09,;4.35,.86,;11.15,2.88,)|
Structure:
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