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BDBM50283752 (S)-2-[(S)-5-((R)-2-Amino-3-mercapto-propionylamino)-2-thiophen-2-ylmethyl-pentanoylamino]-4-methylsulfanyl-butyric acid::CHEMBL316831

SMILES: CSCC[C@H](NC(=O)[C@@H](CCCNC(=O)[C@@H](N)CS)Cc1cccs1)C(O)=O

InChI Key: InChIKey=HMBVZGUDIZJMIK-QEJZJMRPSA-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 = 50283752   
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))
BDBM50283752
PNG
((S)-2-[(S)-5-((R)-2-Amino-3-mercapto-propionylamin...)
Show SMILES CSCC[C@H](NC(=O)[C@@H](CCCNC(=O)[C@@H](N)CS)Cc1cccs1)C(O)=O
Show InChI InChI=1S/C18H29N3O4S3/c1-27-9-6-15(18(24)25)21-16(22)12(10-13-5-3-8-28-13)4-2-7-20-17(23)14(19)11-26/h3,5,8,12,14-15,26H,2,4,6-7,9-11,19H2,1H3,(H,20,23)(H,21,22)(H,24,25)/t12-,14-,15-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
n/an/a 5.10E+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))
BDBM50283752
PNG
((S)-2-[(S)-5-((R)-2-Amino-3-mercapto-propionylamin...)
Show SMILES CSCC[C@H](NC(=O)[C@@H](CCCNC(=O)[C@@H](N)CS)Cc1cccs1)C(O)=O
Show InChI InChI=1S/C18H29N3O4S3/c1-27-9-6-15(18(24)25)21-16(22)12(10-13-5-3-8-28-13)4-2-7-20-17(23)14(19)11-26/h3,5,8,12,14-15,26H,2,4,6-7,9-11,19H2,1H3,(H,20,23)(H,21,22)(H,24,25)/t12-,14-,15-/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 8n/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