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BDBM50261418 CHEMBL4091969

SMILES: CCCCCCCCCCCNC1=N[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

InChI Key: InChIKey=OPJTVWWSISLBHY-FXUDXRNXSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50261418   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Beta-galactosidase/Glucosylceramidase


(Bos taurus (Bovine))
BDBM50261418
PNG
(CHEMBL4091969)
Show SMILES CCCCCCCCCCCNC1=N[C@H](CO)[C@H](O)[C@H](O)[C@H]1O |r,t:12|
Show InChI InChI=1S/C17H34N2O4/c1-2-3-4-5-6-7-8-9-10-11-18-17-16(23)15(22)14(21)13(12-20)19-17/h13-16,20-23H,2-12H2,1H3,(H,18,19)/t13-,14+,15+,16-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.240n/an/an/an/an/an/an/an/a



University of Arkansas

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-galactosidase pre-incubated for 30 mins with 4-nitrophenyl-beta-D-galactopyranoside substrate before enzyme addition ...


Bioorg Med Chem 25: 5194-5202 (2017)


Article DOI: 10.1016/j.bmc.2017.07.020
BindingDB Entry DOI: 10.7270/Q2QF8WBW
More data for this
Ligand-Target Pair
Beta-galactosidase/Glucosylceramidase


(Bos taurus (Bovine))
BDBM50261418
PNG
(CHEMBL4091969)
Show SMILES CCCCCCCCCCCNC1=N[C@H](CO)[C@H](O)[C@H](O)[C@H]1O |r,t:12|
Show InChI InChI=1S/C17H34N2O4/c1-2-3-4-5-6-7-8-9-10-11-18-17-16(23)15(22)14(21)13(12-20)19-17/h13-16,20-23H,2-12H2,1H3,(H,18,19)/t13-,14+,15+,16-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 43n/an/an/an/an/an/a



University of Arkansas

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-galactosidase using 4-nitrophenyl-beta-D-galactopyranoside substrate measured over 240 mins at 10 mins intervals by U...


Bioorg Med Chem 25: 5194-5202 (2017)


Article DOI: 10.1016/j.bmc.2017.07.020
BindingDB Entry DOI: 10.7270/Q2QF8WBW
More data for this
Ligand-Target Pair