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SMILES: C[C@H](NC(=O)c1cnc(C)s1)C(=O)N1CCC(CCc2c(N)nc(C)nc2Cl)CC1

InChI Key: InChIKey=KLRWUOFULIPURB-NSHDSACASA-N

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 367612   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ghrelin O-acyltransferase


(Homo sapiens (Human))
BDBM367612
PNG
(N-[(1S)-2-[4-[2-(4-Amino-6-chloro-2-methyl-pyrimid...)
Show SMILES C[C@H](NC(=O)c1cnc(C)s1)C(=O)N1CCC(CCc2c(N)nc(C)nc2Cl)CC1 |r|
Show InChI InChI=1S/C20H27ClN6O2S/c1-11(24-19(28)16-10-23-13(3)30-16)20(29)27-8-6-14(7-9-27)4-5-15-17(21)25-12(2)26-18(15)22/h10-11,14H,4-9H2,1-3H3,(H,24,28)(H2,22,25,26)/t11-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 96n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Ghrelin O-acyltransferase


(Homo sapiens (Human))
BDBM367612
PNG
(N-[(1S)-2-[4-[2-(4-Amino-6-chloro-2-methyl-pyrimid...)
Show SMILES C[C@H](NC(=O)c1cnc(C)s1)C(=O)N1CCC(CCc2c(N)nc(C)nc2Cl)CC1 |r|
Show InChI InChI=1S/C20H27ClN6O2S/c1-11(24-19(28)16-10-23-13(3)30-16)20(29)27-8-6-14(7-9-27)4-5-15-17(21)25-12(2)26-18(15)22/h10-11,14H,4-9H2,1-3H3,(H,24,28)(H2,22,25,26)/t11-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 96.4n/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