BDBM42612 3-methyl-5-sulfanylidene-2H-isothiazole-4-carboxylic acid ethyl ester::3-methyl-5-thioxo-3-isothiazoline-4-carboxylic acid ethyl ester::MLS000071155::SMR000034068::cid_657881::ethyl 3-methyl-5-sulfanylidene-2H-1,2-thiazole-4-carboxylate

SMILES: CCOC(=O)c1c(C)[nH]sc1=S

InChI Key: InChIKey=MVTVNNIFOTYHJA-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 = 42612   

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
Mitogen-activated protein kinase 10 (Homo sapiens (Human))	BDBM42612 (3-methyl-5-sulfanylidene-2H-isothiazole-4-carboxyl...) Show SMILES CCOC(=O)c1c(C)[nH]sc1=S Show InChI InChI=1S/C7H9NO2S2/c1-3-10-6(9)5-4(2)8-12-7(5)11/h8H,3H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	3.05E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2KK996K
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM42612 (3-methyl-5-sulfanylidene-2H-isothiazole-4-carboxyl...) Show SMILES CCOC(=O)c1c(C)[nH]sc1=S Show InChI InChI=1S/C7H9NO2S2/c1-3-10-6(9)5-4(2)8-12-7(5)11/h8H,3H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	5.75E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q29W0D3P
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM42612 (3-methyl-5-sulfanylidene-2H-isothiazole-4-carboxyl...) Show SMILES CCOC(=O)c1c(C)[nH]sc1=S Show InChI InChI=1S/C7H9NO2S2/c1-3-10-6(9)5-4(2)8-12-7(5)11/h8H,3H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	5.68E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2FN14T0
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM42612 (3-methyl-5-sulfanylidene-2H-isothiazole-4-carboxyl...) Show SMILES CCOC(=O)c1c(C)[nH]sc1=S Show InChI InChI=1S/C7H9NO2S2/c1-3-10-6(9)5-4(2)8-12-7(5)11/h8H,3H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	>6.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2KD1WJB
					More data for this Ligand-Target Pair