BDBM78578 (E)-3-[3-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-4-methoxy-phenyl]-N-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide::(E)-3-[3-[(2-bromo-4-chloro-phenoxy)methyl]-4-methoxy-phenyl]-N-(1,3,5-trimethylpyrazol-4-yl)acrylamide::(E)-3-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(1,3,5-trimethyl-4-pyrazolyl)-2-propenamide::(E)-3-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide::3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)acrylamide::MLS000548222::SMR000115070::cid_5430631

SMILES: COc1ccc(\C=C\C(=O)Nc2c(C)nn(C)c2C)cc1COc1ccc(Cl)cc1Br

InChI Key: InChIKey=YXDWLYAHXWHFOK-UXBLZVDNSA-N

Data: 3 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 3 hits for monomerid = 78578   

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 E2 N (Homo sapiens (Human))	BDBM78578 ((E)-3-[3-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-...) Show SMILES COc1ccc(\C=C\C(=O)Nc2c(C)nn(C)c2C)cc1COc1ccc(Cl)cc1Br Show InChI InChI=1S/C23H23BrClN3O3/c1-14-23(15(2)28(3)27-14)26-22(29)10-6-16-5-8-20(30-4)17(11-16)13-31-21-9-7-18(25)12-19(21)24/h5-12H,13H2,1-4H3,(H,26,29)/b10-6+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.56E+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 CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2X34VX0
					More data for this Ligand-Target Pair
Ubiquitin-conjugating enzyme E2 N (Homo sapiens (Human))	BDBM78578 ((E)-3-[3-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-...) Show SMILES COc1ccc(\C=C\C(=O)Nc2c(C)nn(C)c2C)cc1COc1ccc(Cl)cc1Br Show InChI InChI=1S/C23H23BrClN3O3/c1-14-23(15(2)28(3)27-14)26-22(29)10-6-16-5-8-20(30-4)17(11-16)13-31-21-9-7-18(25)12-19(21)24/h5-12H,13H2,1-4H3,(H,26,29)/b10-6+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.74E+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 CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2SB4462
					More data for this Ligand-Target Pair
Bcl-2-related protein A1 (Mus musculus (Mouse))	BDBM78578 ((E)-3-[3-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-...) Show SMILES COc1ccc(\C=C\C(=O)Nc2c(C)nn(C)c2C)cc1COc1ccc(Cl)cc1Br Show InChI InChI=1S/C23H23BrClN3O3/c1-14-23(15(2)28(3)27-14)26-22(29)10-6-16-5-8-20(30-4)17(11-16)13-31-21-9-7-18(25)12-19(21)24/h5-12H,13H2,1-4H3,(H,26,29)/b10-6+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.32E+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 CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q25D8Q92
					More data for this Ligand-Target Pair