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BDBM50189243 (R)-2-(3,5-dichlorobenzamido)-3-(3,7,11-trimethyldodeca-2,6,10-trienylthio)propanoic acid::CHEMBL209435

SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#16]-[#6]-[#6@H](-[#7]-[#6](=O)-c1cc(Cl)cc(Cl)c1)-[#6](-[#8])=O

InChI Key: InChIKey=STZFCLHZQVDPGE-TUJGGSLHSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50189243   
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
Isoprenylcysteine carboxyl methyltransferase


(Homo sapiens (Human))
BDBM50189243
PNG
((R)-2-(3,5-dichlorobenzamido)-3-(3,7,11-trimethyld...)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#16]-[#6]-[#6@H](-[#7]-[#6](=O)-c1cc(Cl)cc(Cl)c1)-[#6](-[#8])=O
Show InChI InChI=1S/C25H33Cl2NO3S/c1-17(2)7-5-8-18(3)9-6-10-19(4)11-12-32-16-23(25(30)31)28-24(29)20-13-21(26)15-22(27)14-20/h7,9,11,13-15,23H,5-6,8,10,12,16H2,1-4H3,(H,28,29)(H,30,31)/b18-9+,19-11+/t23-/m0/s1
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.30E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of human Icmt by methanol vapour diffusion assay


Bioorg Med Chem Lett 16: 4420-3 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.029
BindingDB Entry DOI: 10.7270/Q27D2TRG
More data for this
Ligand-Target Pair