BDBM50148573 (E,E)-1-piperoylpiperidine::1-[(2E,4E)-5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]piperidine::1-[(2E,4E)-5-(1,3-benzodioxol-5-yl)-2,4-pentadienoyl]piperidine::1-[(2E,4E)-5-(1,3-benzodioxol-5-yl)penta-2,4-dienoyl]piperidine::1-piperoylpiperidine::CHEMBL43185::N-[(E,E)-piperoyl]piperidine::piperine

SMILES: O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1

InChI Key: InChIKey=MXXWOMGUGJBKIW-YPCIICBESA-N

Data: 4 KI  11 IC50  2 EC50  1 ITC

PDB links: 2 PDB IDs match this monomer.

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 17 hits for monomerid = 50148573   

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
Monoamine oxidase (Mus musculus)	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	3.19E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Cambridge Curated by ChEMBL					Assay Description Inhibition of mouse brain MAOB				Bioorg Med Chem Lett 20: 537-40 (2010) Article DOI: 10.1016/j.bmcl.2009.11.106 BindingDB Entry DOI: 10.7270/Q2000264
					More data for this Ligand-Target Pair
Monoamine oxidase (Mus musculus)	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Cambridge Curated by ChEMBL					Assay Description Inhibition of mouse brain MAOA				Bioorg Med Chem Lett 20: 537-40 (2010) Article DOI: 10.1016/j.bmcl.2009.11.106 BindingDB Entry DOI: 10.7270/Q2000264
					More data for this Ligand-Target Pair
Monoamine oxidase (Rattus norvegicus (rat))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	4.93E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Cambridge Curated by ChEMBL					Assay Description Inhibition of MAOA in rat brain mitochondria				Bioorg Med Chem Lett 20: 537-40 (2010) Article DOI: 10.1016/j.bmcl.2009.11.106 BindingDB Entry DOI: 10.7270/Q2000264
					More data for this Ligand-Target Pair
Monoamine Oxidase Type B (MAO-B) (Rattus norvegicus (rat))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	9.13E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Cambridge Curated by ChEMBL					Assay Description Inhibition of MAOB in rat brain mitochondria				Bioorg Med Chem Lett 20: 537-40 (2010) Article DOI: 10.1016/j.bmcl.2009.11.106 BindingDB Entry DOI: 10.7270/Q2000264
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	3.16E+3	n/a	n/a	n/a	n/a
Universidad de Antioquia Curated by ChEMBL					Assay Description Agonist activity at human TRPV1 expressed in tetracycline-stimulated HEK293 cells assessed as increase in intracellular calcium levels by fluorimetri...				Bioorg Med Chem 18: 3299-306 (2010) Article DOI: 10.1016/j.bmc.2010.03.013 BindingDB Entry DOI: 10.7270/Q24M95RD
					More data for this Ligand-Target Pair
P-glycoprotein 1 (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
Dr. Margarete Fischer-Bosch-Institute of Clinical Pharmacology Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of Digoxin transepithelial transport (basal to apical) (Digoxin: 5 uM) in Caco-2 cells				J Pharmacol Exp Ther 302: 645-50 (2002) Article DOI: 10.1124/jpet.102.034728 BindingDB Entry DOI: 10.7270/Q2DB82Z6
					More data for this Ligand-Target Pair
P-glycoprotein 1 (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	7.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
Dr. Margarete Fischer-Bosch-Institute of Clinical Pharmacology Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of Cyclosporin A transepithelial transport (basal to apical) (Cyclosporin A: 1 uM) in Caco-2 cells				J Pharmacol Exp Ther 302: 645-50 (2002) Article DOI: 10.1124/jpet.102.034728 BindingDB Entry DOI: 10.7270/Q2DB82Z6
					More data for this Ligand-Target Pair
Monoamine oxidase (Rattus norvegicus (rat))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	404	n/a	n/a	n/a	n/a	n/a	n/a
General Hospital of PLA Curated by ChEMBL					Assay Description Inhibition of MAO-A in Sprague-Dawley rat brain homogenate using kynuramine as substrate preincubated for 10 mins measured by fluorimetric assay				Bioorg Med Chem Lett 22: 3343-8 (2012) Article DOI: 10.1016/j.bmcl.2012.02.090 BindingDB Entry DOI: 10.7270/Q2JW8FWM
					More data for this Ligand-Target Pair
Monoamine Oxidase Type B (MAO-B) (Rattus norvegicus (rat))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
General Hospital of PLA Curated by ChEMBL					Assay Description Inhibition of MAO-B in Sprague-Dawley rat brain homogenate using kynuramine as substrate preincubated for 10 mins measured by fluorimetric assay				Bioorg Med Chem Lett 22: 3343-8 (2012) Article DOI: 10.1016/j.bmcl.2012.02.090 BindingDB Entry DOI: 10.7270/Q2JW8FWM
					More data for this Ligand-Target Pair
GABA-A receptor; alpha-1/beta-2/gamma-2 (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	5.24E+4	n/a	n/a	n/a	n/a
University of Vienna Curated by ChEMBL					Assay Description Modulation of GABAA alpha1beta2gamma2S receptor (unknown origin) expressed in Xenopus laevis oocytes assessed as potentiation of GABA-induced chlorid...				J Med Chem 57: 5602-19 (2014) Article DOI: 10.1021/jm5002277 BindingDB Entry DOI: 10.7270/Q25X2CXW
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.05E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Porto Curated by ChEMBL					Assay Description Inhibition of human microsomal MAO-B expressed in baculovirus infected BTI-TN-5B1-4 cells assessed as reduction in 4-hydroxyquinoline formation using...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111770
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article	n/a	n/a	4.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of cathepsin D (unknown origin) using hemoglobin as substrate after 30 min by spectrophotometric analysis				Citation and Details Article DOI: 10.1007/s00044-012-0397-z BindingDB Entry DOI: 10.7270/Q29026PM
					More data for this Ligand-Target Pair
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	5.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Northeast Ohio Medical University Curated by ChEMBL					Assay Description Inhibition of MAO-A assessed as inhibition of kyneuramine conversion to 4-hydroxyquinoline after 20 mins by fluorescence assay				Bioorg Med Chem Lett 22: 7183-8 (2012) Article DOI: 10.1016/j.bmcl.2012.09.056 BindingDB Entry DOI: 10.7270/Q29W0GNP
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	483	n/a	n/a	n/a	n/a	n/a	n/a
Northeast Ohio Medical University Curated by ChEMBL					Assay Description Inhibition of MAO-B assessed as inhibition of kyneuramine conversion to 4-hydroxyquinoline after 20 mins by fluorescence assay				Bioorg Med Chem Lett 22: 7183-8 (2012) Article DOI: 10.1016/j.bmcl.2012.09.056 BindingDB Entry DOI: 10.7270/Q29W0GNP
					More data for this Ligand-Target Pair
5-lipoxygenase/FLAP (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	5.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
School of Advanced Sciences Curated by ChEMBL					Assay Description Inhibition of human PMNL 5-LOX using arachidonic acid as substrate after 5 mins by HPLC method				Bioorg Med Chem 27: 3745-3759 (2019) Article DOI: 10.1016/j.bmc.2019.06.040
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	6.00E+7	n/a	n/a	n/a	n/a	7.4	25
GITAM University					Assay Description An SX.18MV-R Applied Photophysics (Oxford, UK) stopped-flow instrument has been used to assay the catalytic/inhibition of various CA isozymes as repo...				J Enzyme Inhib Med Chem 27: 97-100 (2012) Article DOI: 10.3109/14756366.2011.578393 BindingDB Entry DOI: 10.7270/Q2HH6HZG
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...) Show SMILES O=C(\C=C\C=C\c1ccc2OCOc2c1)N1CCCCC1 Show InChI InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+6	n/a	n/a	n/a	n/a	7.4	25
GITAM University					Assay Description An SX.18MV-R Applied Photophysics (Oxford, UK) stopped-flow instrument has been used to assay the catalytic/inhibition of various CA isozymes as repo...				J Enzyme Inhib Med Chem 27: 97-100 (2012) Article DOI: 10.3109/14756366.2011.578393 BindingDB Entry DOI: 10.7270/Q2HH6HZG
					More data for this Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 50148573

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
Lipoxygenase type I-B (LOX) (Glycine max (Soybean))	BDBM50148573 ((E,E)-1-piperoylpiperidine | 1-[(2E,4E)-5-(1,3-ben...)	GoogleScholar	CHEBI KEGG PC cid PC sid PDB		-7.48	608	-616	5.48	8	25
Kannur University, Thalassery Campus					Chem Biol Drug Des 85: 715-21 (2015)