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BDBM50283740 (S)-2-[5-((R)-2-Amino-3-mercapto-propylamino)-2-benzyl-pentanoylamino]-4-methylsulfanyl-butyric acid::CHEMBL94412

SMILES: CSCC[C@H](NC(=O)[C@@H](CCCNC[C@@H](N)CS)Cc1ccccc1)C(O)=O

InChI Key: InChIKey=JVTJLYPWVINCJN-KSZLIROESA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50283740   
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
Geranylgeranyl transferase type I beta subunit/Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50283740
PNG
((S)-2-[5-((R)-2-Amino-3-mercapto-propylamino)-2-be...)
Show SMILES CSCC[C@H](NC(=O)[C@@H](CCCNC[C@@H](N)CS)Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C20H33N3O3S2/c1-28-11-9-18(20(25)26)23-19(24)16(12-15-6-3-2-4-7-15)8-5-10-22-13-17(21)14-27/h2-4,6-7,16-18,22,27H,5,8-14,21H2,1H3,(H,23,24)(H,25,26)/t16-,17+,18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 5.95E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against geranylgeranyl transferase


Bioorg Med Chem Lett 4: 2775-2780 (1994)


Article DOI: 10.1016/S0960-894X(01)80593-X
BindingDB Entry DOI: 10.7270/Q21J99Q0
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50283740
PNG
((S)-2-[5-((R)-2-Amino-3-mercapto-propylamino)-2-be...)
Show SMILES CSCC[C@H](NC(=O)[C@@H](CCCNC[C@@H](N)CS)Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C20H33N3O3S2/c1-28-11-9-18(20(25)26)23-19(24)16(12-15-6-3-2-4-7-15)8-5-10-22-13-17(21)14-27/h2-4,6-7,16-18,22,27H,5,8-14,21H2,1H3,(H,23,24)(H,25,26)/t16-,17+,18-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 80n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of farnesyl transferase


Bioorg Med Chem Lett 4: 2775-2780 (1994)


Article DOI: 10.1016/S0960-894X(01)80593-X
BindingDB Entry DOI: 10.7270/Q21J99Q0
More data for this
Ligand-Target Pair