BDBM46204 (4Z)-2-methoxy-4-[(4-methylpiperidin-1-yl)-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one::(4Z)-2-methoxy-4-[(4-methylpiperidin-1-yl)-sulfanylmethylidene]cyclohexa-2,5-dien-1-one::(4Z)-4-[mercapto-(4-methyl-1-piperidinyl)methylidene]-2-methoxy-1-cyclohexa-2,5-dienone::(4Z)-4-[mercapto-(4-methylpiperidino)methylene]-2-methoxy-cyclohexa-2,5-dien-1-one::MLS-0078446.0001::cid_5347726

SMILES: COc1cc(ccc1O)C(=S)N1CCC(C)CC1

InChI Key: InChIKey=IAROIMQWPVQUGD-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 46204   

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
Hematopoietic protein-tyrosine phosphatase (HEPTP) (Homo sapiens (Human))	BDBM46204 ((4Z)-2-methoxy-4-[(4-methylpiperidin-1-yl)-sulfany...) Show SMILES COc1cc(ccc1O)C(=S)N1CCC(C)CC1 Show InChI InChI=1S/C14H19NO2S/c1-10-5-7-15(8-6-10)14(18)11-3-4-12(16)13(9-11)17-2/h3-4,9-10,16H,5-8H2,1-2H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2474894
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase (VHR) (Homo sapiens (Human))	BDBM46204 ((4Z)-2-methoxy-4-[(4-methylpiperidin-1-yl)-sulfany...) Show SMILES COc1cc(ccc1O)C(=S)N1CCC(C)CC1 Show InChI InChI=1S/C14H19NO2S/c1-10-5-7-15(8-6-10)14(18)11-3-4-12(16)13(9-11)17-2/h3-4,9-10,16H,5-8H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2DB807Z
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase (VHR) (Homo sapiens (Human))	BDBM46204 ((4Z)-2-methoxy-4-[(4-methylpiperidin-1-yl)-sulfany...) Show SMILES COc1cc(ccc1O)C(=S)N1CCC(C)CC1 Show InChI InChI=1S/C14H19NO2S/c1-10-5-7-15(8-6-10)14(18)11-3-4-12(16)13(9-11)17-2/h3-4,9-10,16H,5-8H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.21E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2WW7G20
					More data for this Ligand-Target Pair
Hematopoietic protein-tyrosine phosphatase (HEPTP) (Homo sapiens (Human))	BDBM46204 ((4Z)-2-methoxy-4-[(4-methylpiperidin-1-yl)-sulfany...) Show SMILES COc1cc(ccc1O)C(=S)N1CCC(C)CC1 Show InChI InChI=1S/C14H19NO2S/c1-10-5-7-15(8-6-10)14(18)11-3-4-12(16)13(9-11)17-2/h3-4,9-10,16H,5-8H2,1-2H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q21N7ZJW
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase (VHR) (Homo sapiens (Human))	BDBM46204 ((4Z)-2-methoxy-4-[(4-methylpiperidin-1-yl)-sulfany...) Show SMILES COc1cc(ccc1O)C(=S)N1CCC(C)CC1 Show InChI InChI=1S/C14H19NO2S/c1-10-5-7-15(8-6-10)14(18)11-3-4-12(16)13(9-11)17-2/h3-4,9-10,16H,5-8H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q28K77H7
					More data for this Ligand-Target Pair