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BDBM50283735 (S)-2-{(R)-2-[3-((R)-2-Amino-3-mercapto-propionylamino)-phenyl]-3-phenyl-propionylamino}-4-methylsulfanyl-butyric acid::CHEMBL96295

SMILES: CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)c1cccc(NC(=O)[C@@H](N)CS)c1)C(O)=O

InChI Key: InChIKey=QMIBTVLDZQQTIC-AABGKKOBSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50283735   
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))
BDBM50283735
PNG
((S)-2-{(R)-2-[3-((R)-2-Amino-3-mercapto-propionyla...)
Show SMILES CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)c1cccc(NC(=O)[C@@H](N)CS)c1)C(O)=O
Show InChI InChI=1S/C23H29N3O4S2/c1-32-11-10-20(23(29)30)26-21(27)18(12-15-6-3-2-4-7-15)16-8-5-9-17(13-16)25-22(28)19(24)14-31/h2-9,13,18-20,31H,10-12,14,24H2,1H3,(H,25,28)(H,26,27)(H,29,30)/t18-,19+,20+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
n/an/a 1.17E+4n/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))
BDBM50283735
PNG
((S)-2-{(R)-2-[3-((R)-2-Amino-3-mercapto-propionyla...)
Show SMILES CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)c1cccc(NC(=O)[C@@H](N)CS)c1)C(O)=O
Show InChI InChI=1S/C23H29N3O4S2/c1-32-11-10-20(23(29)30)26-21(27)18(12-15-6-3-2-4-7-15)16-8-5-9-17(13-16)25-22(28)19(24)14-31/h2-9,13,18-20,31H,10-12,14,24H2,1H3,(H,25,28)(H,26,27)(H,29,30)/t18-,19+,20+/m1/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 9.70E+3n/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