BDBM46283 (4E)-4-[[(4-fluoranyl-3-methyl-phenyl)methylamino]-sulfanyl-methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one::(4E)-4-[[(4-fluoro-3-methyl-benzyl)amino]-mercapto-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one::(4E)-4-[[(4-fluoro-3-methylphenyl)methylamino]-mercaptomethylidene]-2-methoxy-1-cyclohexa-2,5-dienone::(4E)-4-[[(4-fluoro-3-methylphenyl)methylamino]-sulfanylmethylidene]-2-methoxycyclohexa-2,5-dien-1-one::MLS-0425620.0001::cid_44229069

SMILES: COc1cc(ccc1O)C(=S)NCc1ccc(F)c(C)c1

InChI Key: InChIKey=IRFCUPDKVSQYCI-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 46283   

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))	BDBM46283 ((4E)-4-[[(4-fluoranyl-3-methyl-phenyl)methylamino]...) Show SMILES COc1cc(ccc1O)C(=S)NCc1ccc(F)c(C)c1 Show InChI InChI=1S/C16H16FNO2S/c1-10-7-11(3-5-13(10)17)9-18-16(21)12-4-6-14(19)15(8-12)20-2/h3-8,19H,9H2,1-2H3,(H,18,21)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	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))	BDBM46283 ((4E)-4-[[(4-fluoranyl-3-methyl-phenyl)methylamino]...) Show SMILES COc1cc(ccc1O)C(=S)NCc1ccc(F)c(C)c1 Show InChI InChI=1S/C16H16FNO2S/c1-10-7-11(3-5-13(10)17)9-18-16(21)12-4-6-14(19)15(8-12)20-2/h3-8,19H,9H2,1-2H3,(H,18,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.33E+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))	BDBM46283 ((4E)-4-[[(4-fluoranyl-3-methyl-phenyl)methylamino]...) Show SMILES COc1cc(ccc1O)C(=S)NCc1ccc(F)c(C)c1 Show InChI InChI=1S/C16H16FNO2S/c1-10-7-11(3-5-13(10)17)9-18-16(21)12-4-6-14(19)15(8-12)20-2/h3-8,19H,9H2,1-2H3,(H,18,21)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	4.33E+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))	BDBM46283 ((4E)-4-[[(4-fluoranyl-3-methyl-phenyl)methylamino]...) Show SMILES COc1cc(ccc1O)C(=S)NCc1ccc(F)c(C)c1 Show InChI InChI=1S/C16H16FNO2S/c1-10-7-11(3-5-13(10)17)9-18-16(21)12-4-6-14(19)15(8-12)20-2/h3-8,19H,9H2,1-2H3,(H,18,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	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/Q2DB807Z
					More data for this Ligand-Target Pair