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Target
D(3) dopamine receptor
Ligand
BDBM50474414
Substrate
n/a
Meas. Tech.
ChEMBL_62595 (CHEMBL674272)
Ki
2.0±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:
BDBM50474414
Synonyms:
CHEMBL2368617
Type:
Small organic molecule
Emp. Form.:
C29H36ClN3O3S
Mol. Mass.:
542.132
SMILES:
Cl.CS(=O)(=O)c1ccc2CCN(CC[C@H]3CC[C@@H](CC3)NC(=O)\C=C\c3ccc(cc3)C#N)CCc2c1 |r,wU:17.19,wD:14.12,(19.41,,;-10.62,-4.24,;-11.39,-2.9,;-12.73,-3.67,;-12.16,-1.57,;-10.06,-2.13,;-10.06,-.59,;-8.73,.18,;-7.39,-.59,;-6.19,.37,;-4.69,.02,;-4.02,-1.36,;-2.48,-1.36,;-1.71,-.03,;-.17,-.03,;.6,-1.36,;2.14,-1.36,;2.91,-.03,;2.14,1.3,;.6,1.3,;4.45,-.03,;5.22,1.3,;4.45,2.64,;6.76,1.3,;7.53,2.64,;9.07,2.64,;9.84,3.97,;11.38,3.97,;12.15,2.64,;11.38,1.3,;9.84,1.3,;13.69,2.64,;15.23,2.64,;-4.69,-2.75,;-6.19,-3.09,;-7.39,-2.13,;-8.73,-2.9,)|
Structure:
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