Reaction Details Report a problem with these data
Target
D(3) dopamine receptor
Ligand
BDBM50391422
Substrate
n/a
Meas. Tech.
ChEMBL_848925 (CHEMBL2149719)
Ki
1.2±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:
BDBM50391422
Synonyms:
CHEMBL2148209
Type:
Small organic molecule
Emp. Form.:
C27H37ClN4OS
Mol. Mass.:
501.127
SMILES:
CCCN(CC[C@H]1CC[C@@H](CC1)NC(=O)\C=C\c1ccccc1Cl)[C@H]1CCc2nc(N)sc2C1 |r,wU:9.12,wD:24.25,6.5,(-2.99,-4.61,;-3,-3.07,;-4.33,-2.3,;-4.34,-.76,;-3,.01,;-1.67,-.76,;-.34,.02,;1,-.76,;2.32,.01,;2.33,1.55,;.99,2.32,;-.35,1.55,;3.66,2.32,;5,1.54,;4.99,0,;6.33,2.31,;7.66,1.54,;9,2.31,;8.99,3.84,;10.32,4.61,;11.66,3.84,;11.66,2.3,;10.32,1.53,;10.31,-.01,;-5.61,.11,;-5.16,1.57,;-6.21,2.7,;-7.7,2.35,;-8.96,3.23,;-10.19,2.31,;-11.66,2.76,;-9.69,.85,;-8.14,.88,;-7.1,-.24,)|
Structure:
Search PDB for entries with ligand similarity: