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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Xylosyl- and glucuronyltransferase LARGE1' and Ligand = 'BDBM51920'   
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
Xylosyl- and glucuronyltransferase LARGE1


(Homo sapiens (Human))
BDBM51920
PNG
(4-(7-ethyl-1H-indol-3-yl)-N-(1-methoxypropan-2-yl)...)
Show SMILES CCc1cccc2c(c[nH]c12)-c1csc(NC(C)COC)n1
Show InChI InChI=1S/C17H21N3OS/c1-4-12-6-5-7-13-14(8-18-16(12)13)15-10-22-17(20-15)19-11(2)9-21-3/h5-8,10-11,18H,4,9H2,1-3H3,(H,19,20)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 4.83E+3n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2VT1QQ4
More data for this
Ligand-Target Pair
Xylosyl- and glucuronyltransferase LARGE1


(Homo sapiens (Human))
BDBM51920
PNG
(4-(7-ethyl-1H-indol-3-yl)-N-(1-methoxypropan-2-yl)...)
Show SMILES CCc1cccc2c(c[nH]c12)-c1csc(NC(C)COC)n1
Show InChI InChI=1S/C17H21N3OS/c1-4-12-6-5-7-13-14(8-18-16(12)13)15-10-22-17(20-15)19-11(2)9-21-3/h5-8,10-11,18H,4,9H2,1-3H3,(H,19,20)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 4.56E+3n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2833QM1
More data for this
Ligand-Target Pair