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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'G-protein coupled receptor 55' and Ligand = 'BDBM50152128'   
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
G-protein coupled receptor 55


(Homo sapiens (Human))
BDBM50152128
PNG
(CHEMBL3775187)
Show SMILES Cc1ccc(cc1)C1(CC1(C)C)C(=O)N1CCC(CC1)n1nc(oc1=O)-c1ccccc1
Show InChI InChI=1S/C26H29N3O3/c1-18-9-11-20(12-10-18)26(17-25(26,2)3)23(30)28-15-13-21(14-16-28)29-24(31)32-22(27-29)19-7-5-4-6-8-19/h4-12,21H,13-17H2,1-3H3
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Article
PubMed
n/an/a 770n/an/an/an/an/an/a



University of North Carolina at Greensboro

Curated by ChEMBL


Assay Description
Antagonist activity at beta-galactosidase fragment-fused GRP55 (unknown origin) over-expressed with N-terminal deletion beta-galactosidase mutant-tag...


Bioorg Med Chem Lett 26: 1827-30 (2016)


Article DOI: 10.1016/j.bmcl.2016.02.030
BindingDB Entry DOI: 10.7270/Q2FQ9ZG5
More data for this
Ligand-Target Pair