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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50379101   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Lysosomal acid glucosylceramidase


(Homo sapiens (Human))
BDBM50379101
PNG
(CHEMBL2012656)
Show SMILES CCCCCCCCCN1[C@H]2[C@H]([C@H](O)[C@@H](O)[C@H](O)[C@H]2O)N(CCCCCCCCC)C1=O
Show InChI InChI=1S/C25H48N2O5/c1-3-5-7-9-11-13-15-17-26-19-20(22(29)24(31)23(30)21(19)28)27(25(26)32)18-16-14-12-10-8-6-4-2/h19-24,28-31H,3-18H2,1-2H3/t19-,20+,21-,22-,23+,24+/m0/s1
PDB
MMDB

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.21E+3n/an/an/an/a7.0n/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human recombinant beta-glucocerebrosidase assessed as 4-methyumbelliferone formation after 30 mins by spectrophotometric analysis at pH...


ACS Med Chem Lett 2: 614-619 (2011)


Article DOI: 10.1021/ml200098j
BindingDB Entry DOI: 10.7270/Q2R78G6C
More data for this
Ligand-Target Pair
Lysosomal acid glucosylceramidase


(Homo sapiens (Human))
BDBM50379101
PNG
(CHEMBL2012656)
Show SMILES CCCCCCCCCN1[C@H]2[C@H]([C@H](O)[C@@H](O)[C@H](O)[C@H]2O)N(CCCCCCCCC)C1=O
Show InChI InChI=1S/C25H48N2O5/c1-3-5-7-9-11-13-15-17-26-19-20(22(29)24(31)23(30)21(19)28)27(25(26)32)18-16-14-12-10-8-6-4-2/h19-24,28-31H,3-18H2,1-2H3/t19-,20+,21-,22-,23+,24+/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.61E+3n/an/an/an/a5.2n/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human recombinant beta-glucocerebrosidase assessed as 4-methyumbelliferone formation after 30 mins by spectrophotometric analysis at pH...


ACS Med Chem Lett 2: 614-619 (2011)


Article DOI: 10.1021/ml200098j
BindingDB Entry DOI: 10.7270/Q2R78G6C
More data for this
Ligand-Target Pair