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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 = 'BDBM50290230'   
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))		BDBM50290230
PNG
(CHEMBL309727 | Thiophene-3-carboxylic acid (4-{2-[...)
Show SMILES Clc1cccc(N2CCN(CC[C@H]3CC[C@@H](CC3)NC(=O)c3ccsc3)CC2)c1Cl |wU:12.11,wD:15.18,(19.23,-5.96,;18.49,-7.31,;19.3,-8.64,;18.56,-9.99,;17.02,-10.02,;16.22,-8.7,;14.68,-8.73,;13.95,-10.06,;12.41,-10.1,;11.6,-8.8,;10.06,-8.83,;9.31,-10.16,;7.77,-10.17,;6.98,-11.5,;5.44,-11.51,;4.67,-10.18,;5.44,-8.85,;6.98,-8.84,;3.15,-10.18,;2.38,-11.51,;.84,-11.53,;3.1,-12.49,;5.21,-14.12,;4.27,-15.34,;2.74,-15.14,;2.15,-13.7,;12.35,-7.45,;13.89,-7.42,;16.96,-7.36,;16.15,-6.04,)|
Show InChI InChI=1S/C23H29Cl2N3OS/c24-20-2-1-3-21(22(20)25)28-13-11-27(12-14-28)10-8-17-4-6-19(7-5-17)26-23(29)18-9-15-30-16-18/h1-3,9,15-17,19H,4-8,10-14H2,(H,26,29)/t17-,19-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
 4.70n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to displace radioligand [3H]spiperone from human dopamine D3 receptor transfected chinese hamster ovary cell membranes.

Bioorg Med Chem Lett 7: 2403-2408 (1997)


Article DOI: 10.1016/S0960-894X(97)00443-5
BindingDB Entry DOI: 10.7270/Q27W6CQ0
More data for this
Ligand-Target Pair