Reaction Details Report a problem with these data
Target
D(3) dopamine receptor
Ligand
BDBM50391407
Substrate
n/a
Meas. Tech.
ChEMBL_848925 (CHEMBL2149719)
Ki
6.7±n/a nM
Citation
 Chen, J; Levant, B; Wang, S High-affinity and selective dopamine D3 receptor full agonists. Bioorg Med Chem Lett 22:5612-7 (2012) [PubMed]  Article 
Target
Name:
D(3) dopamine receptor
Synonyms:
DOPAMINE D3 | DRD3_RAT | Dopamine D3 receptor | Drd3
Type:
Protein
Mol. Mass.:
49540.58
Organism:
Rattus norvegicus (Rat)
Description:
P19020
Residue:
446
Sequence:
MAPLSQISTHLNSTCGAENSTGVNRARPHAYYALSYCALILAIIFGNGLVCAAVLRERALQTTTNYLVVSLAVADLLVATLVMPWVVYLEVTGGVWNFSRICCDVFVTLDVMMCTASILNLCAISIDRYTAVVMPVHYQHGTGQSSCRRVALMITAVWVLAFAVSCPLLFGFNTTGDPSICSISNPDFVIYSSVVSFYVPFGVTVLVYARIYIVLRQRQRKRILTRQNSQCISIRPGFPQQSSCLRLHPIRQFSIRARFLSDATGQMEHIEDKQYPQKCQDPLLSHLQPPSPGQTHGGLKRYYSICQDTALRHPSLEGGAGMSPVERTRNSLSPTMAPKLSLEVRKLSNGRLSTSLRLGPLQPRGVPLREKKATQMVVIVLGAFIVCWLPFFLTHVLNTHCQACHVSPELYRATTWLGYVNSALNPVIYTTFNVEFRKAFLKILSC
  
Inhibitor
Name:
BDBM50391407
Synonyms:
CHEMBL2148210
Type:
Small organic molecule
Emp. Form.:
C28H40N4O2S
Mol. Mass.:
496.708
SMILES:
CCCN(CC[C@H]1CC[C@@H](CC1)NC(=O)\C=C\c1ccc(OC)cc1)[C@H]1CCc2nc(N)sc2C1 |r,wU:9.12,wD:25.26,6.5,(-3.66,-5.38,;-3.66,-3.84,;-5,-3.07,;-5,-1.53,;-3.67,-.76,;-2.34,-1.53,;-1,-.75,;.33,-1.53,;1.66,-.76,;1.66,.78,;.33,1.55,;-1.01,.78,;3,1.55,;4.33,.77,;4.33,-.77,;5.66,1.54,;7,.77,;8.33,1.54,;9.65,.76,;10.99,1.53,;10.99,3.07,;12.33,3.84,;12.33,5.38,;9.65,3.84,;8.32,3.07,;-6.27,-.66,;-5.83,.8,;-6.88,1.93,;-8.36,1.58,;-9.63,2.46,;-10.85,1.54,;-12.33,1.99,;-10.36,.08,;-8.81,.11,;-7.77,-1.01,)|
Structure:
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