BDBM41975 6-[1,3-benzodioxol-5-yl-[4-[1,3-benzodioxol-5-yl-(6-hydroxy-1,3-benzodioxol-5-yl)methyl]-1-piperazinyl]methyl]-1,3-benzodioxol-5-ol::6-[1,3-benzodioxol-5-yl-[4-[1,3-benzodioxol-5-yl-(6-hydroxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol::6-[1,3-benzodioxol-5-yl-[4-[1,3-benzodioxol-5-yl-(6-hydroxy-1,3-benzodioxol-5-yl)methyl]piperazino]methyl]sesamol::6-[1,3-benzodioxol-5-yl-[4-[1,3-benzodioxol-5-yl-(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol::cid_339992
SMILES: Oc1cc2OCOc2cc1C(N1CCN(CC1)C(c1ccc2OCOc2c1)c1cc2OCOc2cc1O)c1ccc2OCOc2c1
InChI Key: InChIKey=VDOTYYGPDCAYHS-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Mothers against decapentaplegic homolog 3 (Homo sapiens (Human)) | BDBM41975 (6-[1,3-benzodioxol-5-yl-[4-[1,3-benzodioxol-5-yl-(...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.41E+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 |