BDBM41201 2-[5-[(4-Ethoxy-phenylamino)-methyl]-4-(4-methoxy-phenyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-N-(5-methyl-isoxazol-3-yl)-acetamide::2-[[4-(4-methoxyphenyl)-5-(p-phenetidinomethyl)-1,2,4-triazol-3-yl]thio]-N-(5-methylisoxazol-3-yl)acetamide::2-[[5-[(4-ethoxyanilino)methyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide::2-[[5-[(4-ethoxyanilino)methyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(5-methyl-3-isoxazolyl)acetamide::2-[[5-[[(4-ethoxyphenyl)amino]methyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide::MLS000031699::SMR000002385::cid_652793

SMILES: CCOc1ccc(NCc2nnc(SCC(=O)Nc3cc(C)on3)n2-c2ccc(OC)cc2)cc1

InChI Key: InChIKey=PJGSTIIZXBZYEU-UHFFFAOYSA-N

Data: 2 IC50  1 EC50

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 3 hits for monomerid = 41201   

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
RNA polymerase beta subunit (EC 2.7.7.6) (Escherichia coli)	BDBM41201 (2-[5-[(4-Ethoxy-phenylamino)-methyl]-4-(4-methoxy-...) Show SMILES CCOc1ccc(NCc2nnc(SCC(=O)Nc3cc(C)on3)n2-c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C24H26N6O4S/c1-4-33-20-9-5-17(6-10-20)25-14-22-27-28-24(30(22)18-7-11-19(32-3)12-8-18)35-15-23(31)26-21-13-16(2)34-29-21/h5-13,25H,4,14-15H2,1-3H3,(H,26,29,31)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	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
PCMD Curated by PubChem BioAssay					Assay Description Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q23N21T1
					More data for this Ligand-Target Pair
Hsf1 protein (Mus musculus)	BDBM41201 (2-[5-[(4-Ethoxy-phenylamino)-methyl]-4-(4-methoxy-...) Show SMILES CCOc1ccc(NCc2nnc(SCC(=O)Nc3cc(C)on3)n2-c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C24H26N6O4S/c1-4-33-20-9-5-17(6-10-20)25-14-22-27-28-24(30(22)18-7-11-19(32-3)12-8-18)35-15-23(31)26-21-13-16(2)34-29-21/h5-13,25H,4,14-15H2,1-3H3,(H,26,29,31)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	>1.95E+5	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2MW2FKX
					More data for this Ligand-Target Pair
large T antigen (Simian virus 40)	BDBM41201 (2-[5-[(4-Ethoxy-phenylamino)-methyl]-4-(4-methoxy-...) Show SMILES CCOc1ccc(NCc2nnc(SCC(=O)Nc3cc(C)on3)n2-c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C24H26N6O4S/c1-4-33-20-9-5-17(6-10-20)25-14-22-27-28-24(30(22)18-7-11-19(32-3)12-8-18)35-15-23(31)26-21-13-16(2)34-29-21/h5-13,25H,4,14-15H2,1-3H3,(H,26,29,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	3.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
Southern Research Specialized Biocontainment Screening Center Curated by PubChem BioAssay					Assay Description A biochemical assay using the ADP-Hunter methodology, purified TAg, and ATP to identify compounds that inhibit the ATPase activity of Tag Southern Re...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2M61HQ8
					More data for this Ligand-Target Pair