BDBM41987 6-[1,3-benzodioxol-5-yl(4-morpholinyl)methyl]-1,3-benzodioxol-5-ol::6-[1,3-benzodioxol-5-yl(morpholin-4-yl)methyl]-1,3-benzodioxol-5-ol::6-[1,3-benzodioxol-5-yl(morpholino)methyl]sesamol::cid_339882

SMILES: Oc1cc2OCOc2cc1C(N1CCOCC1)c1ccc2OCOc2c1

InChI Key: InChIKey=BJEIGUUUOWFEKX-UHFFFAOYSA-N

Data: 1 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 = 41987   

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
Protein disulfide-isomerase (Homo sapiens (Human))	BDBM41987 (6-[1,3-benzodioxol-5-yl(4-morpholinyl)methyl]-1,3-...) Show SMILES Oc1cc2OCOc2cc1C(N1CCOCC1)c1ccc2OCOc2c1 Show InChI InChI=1S/C19H19NO6/c21-14-9-18-17(25-11-26-18)8-13(14)19(20-3-5-22-6-4-20)12-1-2-15-16(7-12)24-10-23-15/h1-2,7-9,19,21H,3-6,10-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars		n/a	n/a	<200	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Mothers against decapentaplegic homolog 3 (Homo sapiens (Human))	BDBM41987 (6-[1,3-benzodioxol-5-yl(4-morpholinyl)methyl]-1,3-...) Show SMILES Oc1cc2OCOc2cc1C(N1CCOCC1)c1ccc2OCOc2c1 Show InChI InChI=1S/C19H19NO6/c21-14-9-18-17(25-11-26-18)8-13(14)19(20-3-5-22-6-4-20)12-1-2-15-16(7-12)24-10-23-15/h1-2,7-9,19,21H,3-6,10-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	>4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: F.M. Hoffmann, University ...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q21R6NZ6
					More data for this Ligand-Target Pair