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SMILES: CCCCc1c(C)nc2ccc(Br)cc2c1SCCC#N

InChI Key: InChIKey=DXCDMEQEVRYHCJ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 33749   

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
Glycylpeptide N-tetradecanoyltransferase 1 (Homo sapiens (Human))	BDBM33749 (3-(6-Bromo-3-butyl-2-methyl-quinolin-4-ylsulfanyl)...) Show SMILES CCCCc1c(C)nc2ccc(Br)cc2c1SCCC#N Show InChI InChI=1S/C17H19BrN2S/c1-3-4-6-14-12(2)20-16-8-7-13(18)11-15(16)17(14)21-10-5-9-19/h7-8,11H,3-6,10H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Imperial College London Curated by ChEMBL					Assay Description Inhibition of human N-myristoyltransferase 1 using human pp60Src92-16 amino acids) as substrate				J Med Chem 55: 3578-82 (2012) Article DOI: 10.1021/jm300040p BindingDB Entry DOI: 10.7270/Q2BC40KN
					More data for this Ligand-Target Pair
Glycylpeptide N-tetradecanoyltransferase 2 (Homo sapiens (Human))	BDBM33749 (3-(6-Bromo-3-butyl-2-methyl-quinolin-4-ylsulfanyl)...) Show SMILES CCCCc1c(C)nc2ccc(Br)cc2c1SCCC#N Show InChI InChI=1S/C17H19BrN2S/c1-3-4-6-14-12(2)20-16-8-7-13(18)11-15(16)17(14)21-10-5-9-19/h7-8,11H,3-6,10H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Imperial College London Curated by ChEMBL					Assay Description Inhibition of human N-myristoyltransferase 2 using human pp60Src92-16 amino acids) as substrate				J Med Chem 55: 3578-82 (2012) Article DOI: 10.1021/jm300040p BindingDB Entry DOI: 10.7270/Q2BC40KN
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM33749 (3-(6-Bromo-3-butyl-2-methyl-quinolin-4-ylsulfanyl)...) Show SMILES CCCCc1c(C)nc2ccc(Br)cc2c1SCCC#N Show InChI InChI=1S/C17H19BrN2S/c1-3-4-6-14-12(2)20-16-8-7-13(18)11-15(16)17(14)21-10-5-9-19/h7-8,11H,3-6,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.5	23
PCMD Curated by PubChem BioAssay					Assay Description HTS was performed using 217,350 compounds of the MLSCN library individually plated into 10ul 1536 compound plates at a concentration of 2.5 mM each, ...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2K64GDN
					More data for this Ligand-Target Pair
Kallikrein-5 (Homo sapiens (Human))	BDBM33749 (3-(6-Bromo-3-butyl-2-methyl-quinolin-4-ylsulfanyl)...) Show SMILES CCCCc1c(C)nc2ccc(Br)cc2c1SCCC#N Show InChI InChI=1S/C17H19BrN2S/c1-3-4-6-14-12(2)20-16-8-7-13(18)11-15(16)17(14)21-10-5-9-19/h7-8,11H,3-6,10H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2GH9GC8
					More data for this Ligand-Target Pair