Reaction Details Report a problem with these data
Target
D(3) dopamine receptor
Ligand
BDBM593765
Substrate
n/a
Meas. Tech.
Binding Inhibition for Dopamine D3 Receptor
Ki
0.048±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:
BDBM593765
Synonyms:
US11578084, Compound I-048
Type:
Small organic molecule
Emp. Form.:
C24H29F5N4O2S
Mol. Mass.:
532.57
SMILES:
FC(F)c1ncccc1C(=O)N[C@H]1CC[C@H](CCN2CCc3nc(OCC(F)(F)F)sc3CC2)CC1 |r,wU:15.16,wD:12.12,(10.19,-4.77,;9.42,-3.44,;7.88,-3.44,;10.19,-2.1,;11.73,-2.1,;12.5,-.77,;11.73,.56,;10.19,.56,;9.42,-.77,;7.88,-.77,;7.11,-2.1,;7.11,.56,;5.57,.56,;4.8,1.9,;3.26,1.9,;2.49,.56,;.95,.56,;.18,1.9,;-1.36,1.9,;-2.03,.51,;-3.53,.17,;-4.74,1.13,;-6.2,.65,;-7.11,1.9,;-8.65,1.9,;-9.42,3.23,;-10.96,3.23,;-12.5,3.23,;-10.96,4.77,;-10.96,1.69,;-6.2,3.14,;-4.74,2.67,;-3.53,3.63,;-2.03,3.28,;3.26,-.77,;4.8,-.77,)|
Structure:
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