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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50052849'   
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(2) dopamine receptor


(Homo sapiens (Human))		BDBM50052849
PNG
(CHEMBL119900 | Trifluoro-methanesulfonic acid (R)-...)
Show SMILES CCCN1CCc2cccc-3c2[C@H]1Cc1ccc(OS(=O)(=O)C(F)(F)F)c(OC)c-31
Show InChI InChI=1S/C21H22F3NO4S/c1-3-10-25-11-9-13-5-4-6-15-18(13)16(25)12-14-7-8-17(20(28-2)19(14)15)29-30(26,27)21(22,23)24/h4-8,16H,3,9-12H2,1-2H3/t16-/m1/s1
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Similars
Article
PubMed
 403n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
In vitro affinity at human cloned Dopamine receptor D2A by [3H]-raclopride displacement.

J Med Chem 39: 3491-502 (1996)


Article DOI: 10.1021/jm960188q
BindingDB Entry DOI: 10.7270/Q2XW4HXS
More data for this
Ligand-Target Pair