Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Protein-S-isoprenylcysteine O-methyltransferase' and Ligand = 'BDBM50327734'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Protein-S-isoprenylcysteine O-methyltransferase (Homo sapiens (Human))	BDBM50327734 (1-(3-methylbut-2-enyl)-3-(piperidin-1-ylmethyl)-5-...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-n1cc(-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)c2cc(ccc12)-c1cccc(-[#6])c1 Show InChI InChI=1S/C26H32N2/c1-20(2)12-15-28-19-24(18-27-13-5-4-6-14-27)25-17-23(10-11-26(25)28)22-9-7-8-21(3)16-22/h7-12,16-17,19H,4-6,13-15,18H2,1-3H3	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
National University of Singapore Curated by ChEMBL					Assay Description Inhibition of recombinant ICMT expressed in Sf9 cells using [3H] AdoMet after 20 mins by scintillation counting				J Med Chem 53: 6838-50 (2010) Article DOI: 10.1021/jm1002843 BindingDB Entry DOI: 10.7270/Q2VT1SB1
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