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BDBM50127309 4-{6-Cyano-3-[(4-cyano-phenyl)-(3-methyl-3H-imidazol-4-yl)-methoxymethyl]-pyridin-2-yl}-piperazine-1-carboxylic acid tert-butyl ester::CHEMBL41518

SMILES: Cn1cncc1C(OCc1ccc(nc1N1CCN(CC1)C(=O)OC(C)(C)C)C#N)c1ccc(cc1)C#N

InChI Key: InChIKey=BLLWRZKPPHTMHT-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50127309   
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
Protein Farnesyltransferase (PFT)


(Bos taurus (bovine))
BDBM50127309
PNG
(4-{6-Cyano-3-[(4-cyano-phenyl)-(3-methyl-3H-imidaz...)
Show SMILES Cn1cncc1C(OCc1ccc(nc1N1CCN(CC1)C(=O)OC(C)(C)C)C#N)c1ccc(cc1)C#N
Show InChI InChI=1S/C28H31N7O3/c1-28(2,3)38-27(36)35-13-11-34(12-14-35)26-22(9-10-23(16-30)32-26)18-37-25(24-17-31-19-33(24)4)21-7-5-20(15-29)6-8-21/h5-10,17,19,25H,11-14,18H2,1-4H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 44n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of transfer of [3H]-FPP to biotin K-ras peptide (KKSKTKCVIM) catalyzed by bovine FTase


Bioorg Med Chem Lett 13: 1571-4 (2003)


BindingDB Entry DOI: 10.7270/Q27080TK
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type I


(Homo sapiens (Human))
BDBM50127309
PNG
(4-{6-Cyano-3-[(4-cyano-phenyl)-(3-methyl-3H-imidaz...)
Show SMILES Cn1cncc1C(OCc1ccc(nc1N1CCN(CC1)C(=O)OC(C)(C)C)C#N)c1ccc(cc1)C#N
Show InChI InChI=1S/C28H31N7O3/c1-28(2,3)38-27(36)35-13-11-34(12-14-35)26-22(9-10-23(16-30)32-26)18-37-25(24-17-31-19-33(24)4)21-7-5-20(15-29)6-8-21/h5-10,17,19,25H,11-14,18H2,1-4H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 42n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of transfer of [3H]-FPP to biotin K-ras peptide (KKSKTKCVIM) catalyzed by bovine GGTase-I


Bioorg Med Chem Lett 13: 1571-4 (2003)


BindingDB Entry DOI: 10.7270/Q27080TK
More data for this
Ligand-Target Pair