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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Lysosomal acid glucosylceramidase' and Ligand = 'BDBM42274'   
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
Lysosomal acid glucosylceramidase


(Homo sapiens (Human))
BDBM42274
PNG
(2-(4-Methoxy-benzenesulfonylamino)-N-{[(tetrahydro...)
Show SMILES COc1ccc(cc1)S(=O)(=O)NCC(=O)N(CC(=O)NCC1CCCO1)c1ccccc1C
Show InChI InChI=1S/C23H29N3O6S/c1-17-6-3-4-8-21(17)26(16-22(27)24-14-19-7-5-13-32-19)23(28)15-25-33(29,30)20-11-9-18(31-2)10-12-20/h3-4,6,8-12,19,25H,5,7,13-16H2,1-2H3,(H,24,27)
PDB
MMDB

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PC cid
PC sid
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n/an/an/an/a>5.00E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q23J3BC8
More data for this
Ligand-Target Pair