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BDBM50189296 CHEMBL3827509

SMILES: COc1cc(\C=C\C(=O)c2cc(C(O)=O)c3c(C)cc(C)cn23)cc(OC)c1OC

InChI Key: InChIKey=DLBJTGOEYREYFT-VOTSOKGWSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50189296   
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)


(Homo sapiens (Human))
BDBM50189296
PNG
(CHEMBL3827509)
Show SMILES COc1cc(\C=C\C(=O)c2cc(C(O)=O)c3c(C)cc(C)cn23)cc(OC)c1OC
Show InChI InChI=1S/C23H23NO6/c1-13-8-14(2)21-16(23(26)27)11-17(24(21)12-13)18(25)7-6-15-9-19(28-3)22(30-5)20(10-15)29-4/h6-12H,1-5H3,(H,26,27)/b7-6+
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 1.59E+4n/an/an/an/an/an/a



Yonsei University

Curated by ChEMBL


Assay Description
Inhibition of FTase (unknown origin)


Bioorg Med Chem Lett 29: 1350-1356 (2019)


Article DOI: 10.1016/j.bmcl.2019.03.044
More data for this
Ligand-Target Pair
Protein Farnesyltransferase (PFT)


(Homo sapiens (Human))
BDBM50189296
PNG
(CHEMBL3827509)
Show SMILES COc1cc(\C=C\C(=O)c2cc(C(O)=O)c3c(C)cc(C)cn23)cc(OC)c1OC
Show InChI InChI=1S/C23H23NO6/c1-13-8-14(2)21-16(23(26)27)11-17(24(21)12-13)18(25)7-6-15-9-19(28-3)22(30-5)20(10-15)29-4/h6-12H,1-5H3,(H,26,27)/b7-6+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

PubMed
n/an/a 1.59E+4n/an/an/an/an/an/a



'Alexandru Ioan Cuza' University of Iasi

Curated by ChEMBL


Assay Description
Inhibition of human recombinant farnesyltransferase using farnesylpyrophosphate and dansyl-GCVLS as substrate measured for 15 mins by fluorescence as...


Bioorg Med Chem Lett 26: 3730-4 (2016)


BindingDB Entry DOI: 10.7270/Q2DR2XFP
More data for this
Ligand-Target Pair