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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Glycylpeptide N-tetradecanoyltransferase' and Ligand = 'BDBM185141'   
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
Glycylpeptide N-tetradecanoyltransferase


(Trypanosoma brucei)
BDBM185141
PNG
(US9156811, DDD100986)
Show SMILES CCCCc1nn(C)c(C)c1NS(=O)(=O)c1ccc(CCCC2CCN(C)CC2)cc1
Show InChI InChI=1S/C24H38N4O2S/c1-5-6-10-23-24(19(2)28(4)25-23)26-31(29,30)22-13-11-20(12-14-22)8-7-9-21-15-17-27(3)18-16-21/h11-14,21,26H,5-10,15-18H2,1-4H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 18n/an/an/an/a7.425



Univeristy of Dundee

US Patent


Assay Description
Measurement of the ability of compounds to inhibit the NMT-1 and/or NMT-2 enzyme isoforms of human, trypanosome (T. brucei), leishmanial (L. major) a...


US Patent US9156811 (2015)


BindingDB Entry DOI: 10.7270/Q2K35SGM
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase


(Leishmania major)
BDBM185141
PNG
(US9156811, DDD100986)
Show SMILES CCCCc1nn(C)c(C)c1NS(=O)(=O)c1ccc(CCCC2CCN(C)CC2)cc1
Show InChI InChI=1S/C24H38N4O2S/c1-5-6-10-23-24(19(2)28(4)25-23)26-31(29,30)22-13-11-20(12-14-22)8-7-9-21-15-17-27(3)18-16-21/h11-14,21,26H,5-10,15-18H2,1-4H3
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 160n/an/an/an/a7.425



Univeristy of Dundee

US Patent


Assay Description
Measurement of the ability of compounds to inhibit the NMT-1 and/or NMT-2 enzyme isoforms of human, trypanosome (T. brucei), leishmanial (L. major) a...


US Patent US9156811 (2015)


BindingDB Entry DOI: 10.7270/Q2K35SGM
More data for this
Ligand-Target Pair