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Target
D(3) dopamine receptor
Ligand
BDBM50474402
Substrate
n/a
Meas. Tech.
ChEMBL_62595 (CHEMBL674272)
Ki
4.0±n/a nM
Citation
 Macdonald, GJ; Branch, CL; Hadley, MS; Johnson, CN; Nash, DJ; Smith, AB; Stemp, G; Thewlis, KM; Vong, AK; Austin, NE; Jeffrey, P; Winborn, KY; Boyfield, I; Hagan, JJ; Middlemiss, DN; Reavill, C; Riley, GJ; Watson, JM; Wood, M; Parker, SG; Ashby, CR Design and synthesis of trans-3-(2-(4-((3-(3-(5-methyl-1,2,4-oxadiazolyl))- phenyl)carboxamido)cyclohexyl)ethyl)-7-methylsulfonyl-2,3,4,5-tetrahydro-1H-3-benzazepine (SB-414796): a potent and selective dopamine D3 receptor antagonist. J Med Chem 46:4952-64 (2003) [PubMed]  Article 
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:
BDBM50474402
Synonyms:
CHEMBL3084615
Type:
Small organic molecule
Emp. Form.:
C30H38ClN3O4S
Mol. Mass.:
572.158
SMILES:
Cl.Cc1cc(on1)-c1cccc(c1)C(=O)N[C@H]1CC[C@H](CCN2CCc3ccc(cc3CC2)S(C)(=O)=O)CC1 |r,wU:16.16,wD:19.20,(15.73,,;10.05,-7.15,;10.21,-5.62,;9.07,-4.59,;9.69,-3.18,;11.23,-3.34,;11.55,-4.85,;8.92,-1.85,;9.69,-.51,;8.92,.82,;7.38,.82,;6.61,-.51,;7.38,-1.85,;5.07,-.51,;4.3,-1.85,;4.3,.82,;2.76,.82,;1.99,-.51,;.45,-.51,;-.32,.82,;-1.86,.82,;-2.63,2.16,;-4.17,2.16,;-4.83,3.54,;-6.34,3.89,;-7.54,2.93,;-8.87,3.7,;-10.21,2.93,;-10.21,1.39,;-8.87,.62,;-7.54,1.39,;-6.34,.43,;-4.83,.77,;-11.54,.62,;-12.31,1.95,;-12.87,-.15,;-10.77,-.72,;.45,2.16,;1.99,2.16,)|
Structure:
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