BDBM50189239 (R)-2-(3,5-dinitrobenzamido)-3-(3,7,11-trimethyldodeca-2,6,10-trienylthio)propanoic acid::CHEMBL212599

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

InChI Key: InChIKey=NLUUQECPOWGYBD-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 = 50189239   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Isoprenylcysteine carboxyl methyltransferase (Homo sapiens (Human))	BDBM50189239 ((R)-2-(3,5-dinitrobenzamido)-3-(3,7,11-trimethyldo...) 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(cc(c1)-[#7+](-[#8-])=O)-[#7+](-[#8-])=O)-[#6](-[#8])=O Show InChI InChI=1S/C25H33N3O7S/c1-17(2)7-5-8-18(3)9-6-10-19(4)11-12-36-16-23(25(30)31)26-24(29)20-13-21(27(32)33)15-22(14-20)28(34)35/h7,9,11,13-15,23H,5-6,8,10,12,16H2,1-4H3,(H,26,29)(H,30,31)/b18-9+,19-11+/t23-/m0/s1	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.43E+4	n/a	n/a	n/a	n/a	n/a	n/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