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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(3) dopamine receptor' and Ligand = 'BDBM50359745'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50359745
PNG
(CHEMBL1928128)
Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(COCCOCCOCCOCCOCCOCc3ccc(cc3)C(=O)NCCCCN3CCN(CC3)c3ccccc3OC)cc2)CC1
Show InChI InChI=1S/C56H80N6O10/c1-65-53-13-5-3-11-51(53)61-31-27-59(28-32-61)25-9-7-23-57-55(63)49-19-15-47(16-20-49)45-71-43-41-69-39-37-67-35-36-68-38-40-70-42-44-72-46-48-17-21-50(22-18-48)56(64)58-24-8-10-26-60-29-33-62(34-30-60)52-12-4-6-14-54(52)66-2/h3-6,11-22H,7-10,23-46H2,1-2H3,(H,57,63)(H,58,64)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
 0.230n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human D3 receptor expressed in CHO cells

Bioorg Med Chem 20: 455-66 (2011)


Article DOI: 10.1016/j.bmc.2011.10.063
BindingDB Entry DOI: 10.7270/Q2R211TP
More data for this
Ligand-Target Pair