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BDBM50283734 (S)-2-[(R)-5-((R)-2-Amino-3-mercapto-propionylamino)-2-(4-methyl-benzyl)-pentanoylamino]-4-methylsulfanyl-butyric acid::CHEMBL95099

SMILES: CSCC[C@H](NC(=O)[C@H](CCCNC(=O)[C@@H](N)CS)Cc1ccc(C)cc1)C(O)=O

InChI Key: InChIKey=CIUXWRBSDIAJKR-SQNIBIBYSA-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 = 50283734   
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))
BDBM50283734
PNG
((S)-2-[(R)-5-((R)-2-Amino-3-mercapto-propionylamin...)
Show SMILES CSCC[C@H](NC(=O)[C@H](CCCNC(=O)[C@@H](N)CS)Cc1ccc(C)cc1)C(O)=O
Show InChI InChI=1S/C21H33N3O4S2/c1-14-5-7-15(8-6-14)12-16(4-3-10-23-20(26)17(22)13-29)19(25)24-18(21(27)28)9-11-30-2/h5-8,16-18,29H,3-4,9-13,22H2,1-2H3,(H,23,26)(H,24,25)(H,27,28)/t16-,17+,18+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
n/an/a 510n/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))
BDBM50283734
PNG
((S)-2-[(R)-5-((R)-2-Amino-3-mercapto-propionylamin...)
Show SMILES CSCC[C@H](NC(=O)[C@H](CCCNC(=O)[C@@H](N)CS)Cc1ccc(C)cc1)C(O)=O
Show InChI InChI=1S/C21H33N3O4S2/c1-14-5-7-15(8-6-14)12-16(4-3-10-23-20(26)17(22)13-29)19(25)24-18(21(27)28)9-11-30-2/h5-8,16-18,29H,3-4,9-13,22H2,1-2H3,(H,23,26)(H,24,25)(H,27,28)/t16-,17+,18+/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 315n/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