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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 = 'BDBM185127'   
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)
BDBM185127
PNG
(US9156811, DDD100888)
Show SMILES Cc1nn(C)c(C)c1N(C(F)F)[S+]([O-])(=O)c1ccc(cc1)-c1ccnc(c1)N1CCNCC1
Show InChI InChI=1S/C22H26F2N6O2S/c1-15-21(16(2)28(3)27-15)30(22(23)24)33(31,32)19-6-4-17(5-7-19)18-8-9-26-20(14-18)29-12-10-25-11-13-29/h4-9,14,22,25H,10-13H2,1-3H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 4n/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)
BDBM185127
PNG
(US9156811, DDD100888)
Show SMILES Cc1nn(C)c(C)c1N(C(F)F)[S+]([O-])(=O)c1ccc(cc1)-c1ccnc(c1)N1CCNCC1
Show InChI InChI=1S/C22H26F2N6O2S/c1-15-21(16(2)28(3)27-15)30(22(23)24)33(31,32)19-6-4-17(5-7-19)18-8-9-26-20(14-18)29-12-10-25-11-13-29/h4-9,14,22,25H,10-13H2,1-3H3
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 5n/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