Reaction Details Report a problem with these data
Target
D(3) dopamine receptor
Ligand
BDBM121521
Substrate
n/a
Meas. Tech.
Radioligand Binding Assay
Ki
2.2±n/a nM
Citation
 Rodriguez Sarmiento, RM; Wichmann, J Benzodioxole piperazine compounds US Patent  US8722683 Publication Date 5/13/2014 
Target
Name:
D(3) dopamine receptor
Synonyms:
DOPAMINE D3 | DRD3 | DRD3_HUMAN | Dopamine D3 receptor | Dopamine D3 receptor (D3) | Dopamine D3 receptor (D3R) | Dopamine receptor | Dopamine receptor (D3) | Dopamine receptor D3
Type:
n/a
Mol. Mass.:
44243.43
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
400
Sequence:
MASLSQLSSHLNYTCGAENSTGASQARPHAYYALSYCALILAIVFGNGLVCMAVLKERALQTTTNYLVVSLAVADLLVATLVMPWVVYLEVTGGVWNFSRICCDVFVTLDVMMCTASILNLCAISIDRYTAVVMPVHYQHGTGQSSCRRVALMITAVWVLAFAVSCPLLFGFNTTGDPTVCSISNPDFVIYSSVVSFYLPFGVTVLVYARIYVVLKQRRRKRILTRQNSQCNSVRPGFPQQTLSPDPAHLELKRYYSICQDTALGGPGFQERGGELKREEKTRNSLSPTIAPKLSLEVRKLSNGRLSTSLKLGPLQPRGVPLREKKATQMVAIVLGAFIVCWLPFFLTHVLNTHCQTCHVSPELYSATTWLGYVNSALNPVIYTTFNIEFRKAFLKILSC
  
Inhibitor
Name:
BDBM121521
Synonyms:
US8722683, 68
Type:
Small organic molecule
Emp. Form.:
C25H32FN3O4S
Mol. Mass.:
489.603
SMILES:
Fc1ccc(cc1)S(=O)(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc3OCOc23)CC1 |r,wU:11.11,wD:14.15,(10.65,-3.51,;9.56,-2.42,;8.07,-2.82,;6.98,-1.73,;7.38,-.24,;8.87,.15,;9.96,-.94,;6.29,.84,;4.96,.07,;7.63,1.61,;5.52,2.18,;3.98,2.18,;3.21,.84,;1.67,.84,;.9,2.18,;-.64,2.18,;-1.41,.84,;-2.95,.84,;-3.72,-.49,;-5.26,-.49,;-6.03,.84,;-5.26,2.18,;-3.72,2.18,;-7.57,.84,;-8.34,2.18,;-9.88,2.18,;-10.65,.84,;-9.88,-.49,;-10.35,-1.95,;-9.11,-2.86,;-7.86,-1.95,;-8.34,-.49,;1.67,3.51,;3.21,3.51,)|
Structure:
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