BDBM61185 (E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)sulfamoyl]anilino]-sulfanylidenemethyl]-2-propenamide::(E)-3-(2-furyl)-N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]thiocarbamoyl]acrylamide::(E)-3-(furan-2-yl)-N-[[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamothioyl]prop-2-enamide::MLS000716231::SMR000277748::cid_1986560

SMILES: COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1

InChI Key: InChIKey=PPYMPELJQZQIBQ-UHFFFAOYSA-N

Data: 12 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 12 hits for monomerid = 61185   

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
ubiquitin-conjugating enzyme E2I (Homo sapiens (Human))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.41E+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 (2010) BindingDB Entry DOI: 10.7270/Q2V986G8
					More data for this Ligand-Target Pair
SUMO1 activating enzyme subunit 1 (Homo sapiens (Human))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.61E+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 (2010) BindingDB Entry DOI: 10.7270/Q2BP0175
					More data for this Ligand-Target Pair
Intestinal alkaline phosphatase (Homo sapiens (Human))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB MMDB 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, CA...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2X63KDM
					More data for this Ligand-Target Pair
Alkaline phosphatase placental-like (Homo sapiens (Human))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.51E+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 (2010) BindingDB Entry DOI: 10.7270/Q2NS0SCW
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	4.59E+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 (2010) BindingDB Entry DOI: 10.7270/Q2H130G1
					More data for this Ligand-Target Pair
tyrosyl-DNA phosphodiesterase 2 (Homo sapiens (Human))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL 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
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...				PubChem Bioassay (2014) BindingDB Entry DOI: 10.7270/Q2WS8RXV
					More data for this Ligand-Target Pair
cysteine protease ATG4B isoform a (Homo sapiens (Human))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	6.00E+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 (2011) BindingDB Entry DOI: 10.7270/Q2BZ64H1
					More data for this Ligand-Target Pair
Phospholipase A2 (Homo sapiens (Human))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>8.00E+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 (2011) BindingDB Entry DOI: 10.7270/Q26M35BC
					More data for this Ligand-Target Pair
Thrombin (Bos taurus (Bovine))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.05E+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, La Jolla, CA...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2JM286J
					More data for this Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (DNMT1) (Homo sapiens (Human))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.92E+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 (2012) BindingDB Entry DOI: 10.7270/Q2NC5ZRN
					More data for this Ligand-Target Pair
26S Proteasome regulatory subunit Rpn11 (Rpn11) (Homo sapiens (Human))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.29E+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, La Jolla, CA...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2PC30Z9
					More data for this Ligand-Target Pair
Alpi (Rattus norvegicus (Rat))	BDBM61185 ((E)-3-(2-furanyl)-N-[[4-[(6-methoxy-4-pyrimidinyl)...) Show SMILES COc1cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)C=Cc3ccco3)cc2)ncn1 |w:19.18| Show InChI InChI=1S/C19H17N5O5S2/c1-28-18-11-16(20-12-21-18)24-31(26,27)15-7-4-13(5-8-15)22-19(30)23-17(25)9-6-14-3-2-10-29-14/h2-12H,1H3,(H,20,21,24)(H2,22,23,25,30)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.84E+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 (2010) BindingDB Entry DOI: 10.7270/Q2DB809V
					More data for this Ligand-Target Pair