BDBM41985 6-[1-piperidinyl-(3,4,5-trimethoxyphenyl)methyl]-1,3-benzodioxol-5-ol::6-[piperidin-1-yl-(3,4,5-trimethoxyphenyl)methyl]-1,3-benzodioxol-5-ol::6-[piperidino-(3,4,5-trimethoxyphenyl)methyl]sesamol::cid_339887
SMILES: COc1cc(cc(OC)c1OC)C(N1CCCCC1)c1cc2OCOc2cc1O
InChI Key: InChIKey=AOFTVDRTEGBGAK-UHFFFAOYSA-N
Data: 1 IC50
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)) | BDBM41985 (6-[1-piperidinyl-(3,4,5-trimethoxyphenyl)methyl]-1...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | n/a | n/a | 700 | 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)) | BDBM41985 (6-[1-piperidinyl-(3,4,5-trimethoxyphenyl)methyl]-1...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.25E+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 |