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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 = 'BDBM50040145'   
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


(BOVINE)		BDBM50040145
PNG
(7,9-Dimethyl-5-propylsulfanyl-4,6,6a,7,8,9,10,10a-...)
Show SMILES CCCSc1[nH]c2cccc3[C@H]4C[C@@H](C)CN(C)[C@@H]4Cc1c23
Show InChI InChI=1S/C19H26N2S/c1-4-8-22-19-15-10-17-14(9-12(2)11-21(17)3)13-6-5-7-16(20-19)18(13)15/h5-7,12,14,17,20H,4,8-11H2,1-3H3/t12-,14-,17-/m1/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Lilly Research Centre Ltd.

Curated by ChEMBL


Assay Description
Competition in vitro with the dopamine receptor D2 anatagonist [3H]-spiperone, for binding sites on calf caudate membranes.

J Med Chem 36: 912-8 (1993)


BindingDB Entry DOI: 10.7270/Q2FJ2FT2
More data for this
Ligand-Target Pair