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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 = 'BDBM50135357'   
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))
BDBM50135357
PNG
(6-[(4-Cyano-phenyl)-thiazol-5-yl-methoxymethyl]-5-...)
Show SMILES Cn1c(COC(c2cncs2)c2ccc(cc2)C#N)c(cc(C#N)c1=O)-c1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C25H16Cl2N4O2S/c1-31-22(21(8-18(11-29)25(31)32)17-6-19(26)9-20(27)7-17)13-33-24(23-12-30-14-34-23)16-4-2-15(10-28)3-5-16/h2-9,12,14,24H,13H2,1H3
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PubMed
n/an/a 1.90n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against farnesyltransferase (FT)


Bioorg Med Chem Lett 13: 4001-5 (2003)


BindingDB Entry DOI: 10.7270/Q2H41QVX
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50135357
PNG
(6-[(4-Cyano-phenyl)-thiazol-5-yl-methoxymethyl]-5-...)
Show SMILES Cn1c(COC(c2cncs2)c2ccc(cc2)C#N)c(cc(C#N)c1=O)-c1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C25H16Cl2N4O2S/c1-31-22(21(8-18(11-29)25(31)32)17-6-19(26)9-20(27)7-17)13-33-24(23-12-30-14-34-23)16-4-2-15(10-28)3-5-16/h2-9,12,14,24H,13H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/an/an/a>100n/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro effective concentration of the compound against farnesyltransferase (FT)


Bioorg Med Chem Lett 13: 4001-5 (2003)


BindingDB Entry DOI: 10.7270/Q2H41QVX
More data for this
Ligand-Target Pair