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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha' and Ligand = 'BDBM50283540'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50283540
PNG
((S)-2-{3-[((R)-2-Amino-3-mercapto-propionylamino)-...)
Show SMILES CSCC[C@H](NC(=O)c1cccc(CNC(=O)[C@@H]([NH3+])CS)c1)C([O-])=O
Show InChI InChI=1S/C16H23N3O4S2/c1-25-6-5-13(16(22)23)19-14(20)11-4-2-3-10(7-11)8-18-15(21)12(17)9-24/h2-4,7,12-13,24H,5-6,8-9,17H2,1H3,(H,18,21)(H,19,20)(H,22,23)/t12-,13-/m0/s1
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Article
n/an/a 350n/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
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50283540
PNG
((S)-2-{3-[((R)-2-Amino-3-mercapto-propionylamino)-...)
Show SMILES CSCC[C@H](NC(=O)c1cccc(CNC(=O)[C@@H]([NH3+])CS)c1)C([O-])=O
Show InChI InChI=1S/C16H23N3O4S2/c1-25-6-5-13(16(22)23)19-14(20)11-4-2-3-10(7-11)8-18-15(21)12(17)9-24/h2-4,7,12-13,24H,5-6,8-9,17H2,1H3,(H,18,21)(H,19,20)(H,22,23)/t12-,13-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
n/an/a 380n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of [3H]FPP incorporation into recombinant P21ras of NIH3T3 cells by farnesyl transferase


Bioorg Med Chem Lett 4: 2579-2584 (1994)


Article DOI: 10.1016/S0960-894X(01)80287-0
BindingDB Entry DOI: 10.7270/Q29C6XXR
More data for this
Ligand-Target Pair