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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Ghrelin O-acyltransferase' and Ligand = 'BDBM367615'   
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
Ghrelin O-acyltransferase


(Homo sapiens (Human))		BDBM367615
PNG
(Methyl N-[(1S)-2-[4-[2-(4-amino-6-chloro-2-methyl-...)
Show SMILES COC(=O)N[C@@H](C)C(=O)N1CCC(CCc2c(N)nc(C)nc2Cl)CC1 |r|
Show InChI InChI=1S/C17H26ClN5O3/c1-10(20-17(25)26-3)16(24)23-8-6-12(7-9-23)4-5-13-14(18)21-11(2)22-15(13)19/h10,12H,4-9H2,1-3H3,(H,20,25)(H2,19,21,22)/t10-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 149n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human His-tagged GOAT expressed in baculovirus infected Sf9 cell membrane using desacyl-ghrelin-biotin and octanoyl-CoA as substrate in...

Citation and Details

Article DOI: 10.1039/d0md00210k
BindingDB Entry DOI: 10.7270/Q2KS6W53
More data for this
Ligand-Target Pair
Ghrelin O-acyltransferase


(Homo sapiens (Human))		BDBM367615
PNG
(Methyl N-[(1S)-2-[4-[2-(4-amino-6-chloro-2-methyl-...)
Show SMILES COC(=O)N[C@@H](C)C(=O)N1CCC(CCc2c(N)nc(C)nc2Cl)CC1 |r|
Show InChI InChI=1S/C17H26ClN5O3/c1-10(20-17(25)26-3)16(24)23-8-6-12(7-9-23)4-5-13-14(18)21-11(2)22-15(13)19/h10,12H,4-9H2,1-3H3,(H,20,25)(H2,19,21,22)/t10-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 149n/an/an/an/an/an/a



Wyeth Research



Assay Description
Prepare test compounds in DMSO to make up a 0.2 mM stock solution. Serially dilute the stock solution in DMSO for ten concentrations with final compo...

J Med Chem 51: 1319-23 (2008)


BindingDB Entry DOI: 10.7270/Q2KW5JBV
More data for this
Ligand-Target Pair