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BDBM13360 (2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-methylbutanamido]-3-(2,4-dimethylphenyl)propanamido]-4-(methylsulfanyl)butanoic acid::CAAX Analogue 3::Compound III

SMILES: CSCC[C@H](NC(=O)[C@@H](Cc1ccc(C)cc1C)NC(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C)C(O)=O

InChI Key: InChIKey=OSCYYRDQLWFHKF-HAGHYFMRSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 13360   
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
Protein farnesyltransferase


(Bos taurus (bovine))
BDBM13360
PNG
((2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpro...)
Show SMILES CSCC[C@H](NC(=O)[C@@H](Cc1ccc(C)cc1C)NC(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C)C(O)=O |r|
Show InChI InChI=1S/C24H38N4O5S2/c1-13(2)20(28-21(29)17(25)12-34)23(31)27-19(11-16-7-6-14(3)10-15(16)4)22(30)26-18(24(32)33)8-9-35-5/h6-7,10,13,17-20,34H,8-9,11-12,25H2,1-5H3,(H,26,30)(H,27,31)(H,28,29)(H,32,33)/t17-,18-,19+,20-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.30E+3n/an/an/an/a7.537



Universita di Napoli Federico II



Assay Description
Assays for PFT activity were performed with a PFT-specific scintillation assay (SPA) kit (Amersham Biosciences, Piscataway, NJ). IC50 values were cal...


J Med Chem 49: 1882-90 (2006)


Article DOI: 10.1021/jm0506165
BindingDB Entry DOI: 10.7270/Q22V2DCH
More data for this
Ligand-Target Pair