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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 = 'BDBM476779'   
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))		BDBM476779
PNG
(US10870660, Compound III-168 | US11345716, Compoun...)
Show SMILES Cn1cc(\C=C\C(=O)N[C@H]2CC[C@H](CCN3CCc4nc(OCC(F)(F)F)sc4CC3)OC2)cn1 |r|
Show InChI InChI=1S/C23H30F3N5O3S/c1-30-13-16(12-27-30)2-5-21(32)28-17-3-4-18(33-14-17)6-9-31-10-7-19-20(8-11-31)35-22(29-19)34-15-23(24,25)26/h2,5,12-13,17-18H,3-4,6-11,14-15H2,1H3,(H,28,32)/b5-2+/t17-,18+/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 0.130n/an/an/an/an/an/an/an/a



SHIONOGI & CO., LTD.

US Patent


Assay Description
225 nL of the solutions of the non-specific ligand or the compounds of the present invention at each concentration (in case of vehicle, final concent...

US Patent US10870660 (2020)


BindingDB Entry DOI: 10.7270/Q2M61PBD
More data for this
Ligand-Target Pair