Reaction Details Report a problem with these data
Target
D(3) dopamine receptor
Ligand
BDBM593793
Substrate
n/a
Meas. Tech.
Binding Inhibition for Dopamine D3 Receptor
Ki
0.100±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:
BDBM593793
Synonyms:
US11578084, Compound I-076
Type:
Small organic molecule
Emp. Form.:
C30H41N5O2
Mol. Mass.:
503.6788
SMILES:
CC[C@@H](C)Oc1ccc2CCN(CC[C@H]3CC[C@@H](CC3)NC(=O)c3cccc4nn(C)cc34)CCc2n1 |r,wU:14.13,2.2,wD:17.20,(-12.43,-.54,;-11.66,-1.87,;-10.12,-1.87,;-9.35,-.54,;-9.35,-3.21,;-7.81,-3.21,;-7.04,-4.54,;-5.5,-4.54,;-4.73,-3.21,;-3.21,-3.43,;-2.08,-2.39,;-2.19,-.85,;-.86,-.08,;.47,-.85,;1.81,-.08,;1.81,1.46,;3.14,2.23,;4.47,1.46,;4.47,-.08,;3.14,-.85,;5.81,2.23,;7.14,1.46,;7.14,-.08,;8.48,2.23,;8.48,3.77,;9.81,4.54,;11.14,3.77,;11.14,2.23,;12.29,1.2,;11.66,-.21,;12.43,-1.54,;10.13,-.05,;9.81,1.46,;-3.47,.02,;-4.94,-.44,;-5.5,-1.87,;-7.04,-1.87,)|
Structure:
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