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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Glycylpeptide N-tetradecanoyltransferase 1/2' and Ligand = 'BDBM50471306'   
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 1/2


(Homo sapiens (Human))
BDBM50471306
PNG
(CHEMBL86856)
Show SMILES CC(C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1CCCCC1)C(O)=O)c1ccc(CCCCn2ccnc2C)cc1
Show InChI InChI=1S/C35H54N6O6/c1-24(28-16-14-26(15-17-28)10-7-9-20-41-21-19-37-25(41)2)32(43)40-31(23-42)34(45)38-29(13-6-8-18-36)33(44)39-30(35(46)47)22-27-11-4-3-5-12-27/h14-17,19,21,24,27,29-31,42H,3-13,18,20,22-23,36H2,1-2H3,(H,38,45)(H,39,44)(H,40,43)(H,46,47)/t24?,29-,30-,31-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 380n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of candida albicans.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 1/2


(Homo sapiens (Human))
BDBM50471306
PNG
(CHEMBL86856)
Show SMILES CC(C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1CCCCC1)C(O)=O)c1ccc(CCCCn2ccnc2C)cc1
Show InChI InChI=1S/C35H54N6O6/c1-24(28-16-14-26(15-17-28)10-7-9-20-41-21-19-37-25(41)2)32(43)40-31(23-42)34(45)38-29(13-6-8-18-36)33(44)39-30(35(46)47)22-27-11-4-3-5-12-27/h14-17,19,21,24,27,29-31,42H,3-13,18,20,22-23,36H2,1-2H3,(H,38,45)(H,39,44)(H,40,43)(H,46,47)/t24?,29-,30-,31-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.40E+5n/an/an/an/an/an/a



G.D. Searle and Company

Curated by ChEMBL


Assay Description
Inhibition activity against N-myristoyltransferase (NMT) of human.


J Med Chem 40: 2609-25 (1997)


Article DOI: 10.1021/jm970094w
BindingDB Entry DOI: 10.7270/Q2BR8VXS
More data for this
Ligand-Target Pair