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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 = 'BDBM50139199'   
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))
BDBM50139199
PNG
(23-oxo-8-oxa-1,15,17,21-tetraazapentacyclo[19.2.2....)
Show SMILES O=C1CN2CCN1Cc1cccc(Oc3cc(Cn4cncc4C2)ccc3C#N)c1
Show InChI InChI=1S/C23H21N5O2/c24-10-19-5-4-18-9-22(19)30-21-3-1-2-17(8-21)12-27-7-6-26(15-23(27)29)14-20-11-25-16-28(20)13-18/h1-5,8-9,11,16H,6-7,12-15H2
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PubMed
n/an/a 2.20n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human Farnesyltransferase -catalyzed incorporation of [3H]-FPP into recombinant Ras-CVIM.


Bioorg Med Chem Lett 14: 639-43 (2004)


BindingDB Entry DOI: 10.7270/Q2WM1CTK
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50139199
PNG
(23-oxo-8-oxa-1,15,17,21-tetraazapentacyclo[19.2.2....)
Show SMILES O=C1CN2CCN1Cc1cccc(Oc3cc(Cn4cncc4C2)ccc3C#N)c1
Show InChI InChI=1S/C23H21N5O2/c24-10-19-5-4-18-9-22(19)30-21-3-1-2-17(8-21)12-27-7-6-26(15-23(27)29)14-20-11-25-16-28(20)13-18/h1-5,8-9,11,16H,6-7,12-15H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 3.30n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of radiolabeled FTI from Farnesyltransferase in cultured Ha-ras transformed RAT1 cells.


Bioorg Med Chem Lett 14: 639-43 (2004)


BindingDB Entry DOI: 10.7270/Q2WM1CTK
More data for this
Ligand-Target Pair