BDBM50332181 2-(4-Methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)acrylonitrile::CHEMBL1288165::NSC-332172

SMILES: COc1ccc(cc1)C(=C/c1cc(OC)c(OC)c(OC)c1)\C#N

InChI Key: InChIKey=TWQVQTHANQGUMN-DHDCSXOGSA-N

Data: 2 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 2 hits for monomerid = 50332181   

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
NAD(P)H dehydrogenase [quinone] 1 (Homo sapiens (Human))	BDBM50332181 (2-(4-Methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)acry...) Show SMILES COc1ccc(cc1)C(=C/c1cc(OC)c(OC)c(OC)c1)\C#N Show InChI InChI=1S/C19H19NO4/c1-21-16-7-5-14(6-8-16)15(12-20)9-13-10-17(22-2)19(24-4)18(11-13)23-3/h5-11H,1-4H3/b15-9-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester and Manchester Cancer Research Center Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO1				Bioorg Med Chem Lett 20: 7331-6 (2010) Article DOI: 10.1016/j.bmcl.2010.10.070 BindingDB Entry DOI: 10.7270/Q2M32W16
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50332181 (2-(4-Methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)acry...) Show SMILES COc1ccc(cc1)C(=C/c1cc(OC)c(OC)c(OC)c1)\C#N Show InChI InChI=1S/C19H19NO4/c1-21-16-7-5-14(6-8-16)15(12-20)9-13-10-17(22-2)19(24-4)18(11-13)23-3/h5-11H,1-4H3/b15-9-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester and Manchester Cancer Research Center Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2				Bioorg Med Chem Lett 20: 7331-6 (2010) Article DOI: 10.1016/j.bmcl.2010.10.070 BindingDB Entry DOI: 10.7270/Q2M32W16
					More data for this Ligand-Target Pair