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SMILES: CCCCNC(=O)CSc1nnc(-c2ccco2)n1C

InChI Key: InChIKey=WHRDQZKTWQTFRP-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 35357   

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
Dual specificity protein phosphatase 6 (Rattus norvegicus)	BDBM35357 (MLS000033335 | N-Butyl-2-(5-furan-2-yl-4-methyl-4H...) Show SMILES CCCCNC(=O)CSc1nnc(-c2ccco2)n1C Show InChI InChI=1S/C13H18N4O2S/c1-3-4-7-14-11(18)9-20-13-16-15-12(17(13)2)10-6-5-8-19-10/h5-6,8H,3-4,7,9H2,1-2H3,(H,14,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Pittsburgh Molecular Library Screening Center Curated by PubChem BioAssay					Assay Description The in vitro MKP-3 Phosphatase dose response hit/probe assessment assay has been developed and run at the University of Pittsburgh Molecular Screenin...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2H70D6B
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase 1 (Homo sapiens (Human))	BDBM35357 (MLS000033335 | N-Butyl-2-(5-furan-2-yl-4-methyl-4H...) Show SMILES CCCCNC(=O)CSc1nnc(-c2ccco2)n1C Show InChI InChI=1S/C13H18N4O2S/c1-3-4-7-14-11(18)9-20-13-16-15-12(17(13)2)10-6-5-8-19-10/h5-6,8H,3-4,7,9H2,1-2H3,(H,14,18)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.0	22
University of Pittsburgh Molecular Library Screening Center Curated by PubChem BioAssay					Assay Description The MKP-1 HTS confirmation dose response assay has been developed to confirm actives identified in the MH-76391 In vitro HTS assay for MKP-1 inhibito...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2F769WQ
					More data for this Ligand-Target Pair