Reaction Details Report a problem with these data
Target
D(3) dopamine receptor
Ligand
BDBM593859
Substrate
n/a
Meas. Tech.
Binding Inhibition for Dopamine D3 Receptor
Ki
0.120±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:
BDBM593859
Synonyms:
US11578084, Compound I'-7
Type:
Small organic molecule
Emp. Form.:
C27H36F3N5O2
Mol. Mass.:
519.6022
SMILES:
Cc1ncc(OCC(=O)N[C@H]2CC[C@H](CCN3CCc4ccc(CCC(F)(F)F)nc4CC3)CC2)cn1 |r,wU:13.13,wD:10.9,(14.17,4.54,;12.84,3.77,;12.84,2.23,;11.5,1.46,;10.17,2.23,;8.84,1.46,;7.5,2.23,;6.17,1.46,;6.17,-.08,;4.84,2.23,;3.5,1.46,;2.17,2.23,;.84,1.46,;.84,-.08,;-.5,-.85,;-1.83,-.08,;-3.17,-.85,;-3.05,-2.39,;-4.18,-3.43,;-5.7,-3.21,;-6.47,-4.54,;-8.01,-4.54,;-8.78,-3.21,;-10.32,-3.21,;-11.09,-1.87,;-12.63,-1.87,;-13.4,-.54,;-13.4,-3.21,;-14.17,-1.87,;-8.01,-1.87,;-6.47,-1.87,;-5.91,-.44,;-4.44,.02,;2.17,-.85,;3.5,-.08,;10.17,3.77,;11.5,4.54,)|
Structure:
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