BDBM43254 (1Z)-1-[(benzylamino)methylene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one::(1Z)-1-[(benzylamino)methylidene]-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-one::(1Z)-3-nitro-1-[[(phenylmethyl)amino]methylidene]-6,7,8,9-tetrahydrodibenzofuran-2-one::1-[(E)-Benzylimino-methyl]-3-nitro-6,7,8,9-tetrahydro-dibenzofuran-2-ol::MLS000587848::SMR000211848::cid_6348160
SMILES: [O-][N+](=O)c1cc2oc3CCCCc3c2[c-](\C=[NH+]\Cc2ccccc2)c1=O
InChI Key: InChIKey=WGTUGZWXQBEDJE-CIAFOILYSA-O
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ras-related protein Rab-2A. (Canis lupus familiaris) | BDBM43254 ((1Z)-1-[(benzylamino)methylene]-3-nitro-6,7,8,9-te...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 4.02E+3 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2T15221 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Phospholipase A2 (Homo sapiens (Human)) | BDBM43254 ((1Z)-1-[(benzylamino)methylene]-3-nitro-6,7,8,9-te...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 502 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q26M35BC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
cysteine protease ATG4B isoform a (Homo sapiens (Human)) | BDBM43254 ((1Z)-1-[(benzylamino)methylene]-3-nitro-6,7,8,9-te...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.28E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2BZ64H1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Ras-related C3 botulinum toxin substrate 1 (Mus musculus) | BDBM43254 ((1Z)-1-[(benzylamino)methylene]-3-nitro-6,7,8,9-te...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 5.79E+3 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2PC30S2 | |||||||||||
More data for this Ligand-Target Pair |