BDBM108083 3-(4-nitrobenzylidene)indolin-2-one (Compound 24)
SMILES: [O-][N+](=O)c1ccc(\C=C2/C(=O)Nc3ccccc23)cc1
InChI Key: InChIKey=WPZSQSSOBHCYOZ-LCYFTJDESA-N
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 |
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Beta amyloid A4 protein (Homo sapiens (Human)) | BDBM108083 (3-(4-nitrobenzylidene)indolin-2-one (Compound 24)) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PubMed | 325 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Washington University School of Medicine Curated by ChEMBL | Assay Description Displacement of Thio-T from amyloid beta (1 to 42) (unknown origin) expressed in Escherichia coli after 1.5 hrs by fluorescence assay | J Med Chem 58: 6002-17 (2015) BindingDB Entry DOI: 10.7270/Q24Q7WRC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Alpha-synuclein (Homo sapiens (Human)) | BDBM108083 (3-(4-nitrobenzylidene)indolin-2-one (Compound 24)) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PubMed | 347 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Washington University School of Medicine Curated by ChEMBL | Assay Description Displacement of Thio-T from recombinant alpha-synuclein (unknown origin) expressed in Escherichia coli after 1.5 hrs by fluorescence assay | J Med Chem 58: 6002-17 (2015) BindingDB Entry DOI: 10.7270/Q24Q7WRC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Tau (Homo sapiens (Human)) | BDBM108083 (3-(4-nitrobenzylidene)indolin-2-one (Compound 24)) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PubMed | 363 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Washington University School of Medicine Curated by ChEMBL | Assay Description Displacement of Thio-T from human recombinant tau (243 to 375) expressed in Escherichia coli BL21(DE3)RIL after 1.5 hrs by fluorescence assay | J Med Chem 58: 6002-17 (2015) BindingDB Entry DOI: 10.7270/Q24Q7WRC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Chorismate mutase (MTB CM) (Mycobacterium tuberculosis H37Rv) | BDBM108083 (3-(4-nitrobenzylidene)indolin-2-one (Compound 24)) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.01E+3 | n/a | n/a | n/a | n/a | n/a | 37 |
Birla Institute of Technology & Science-Pilani, Hyderabad Campus, Shameerpet, R.R. District, Hyderabad, Andhra Pradesh, 500078, India | Assay Description The reaction was initiated by the addition of 150pmoles of enzyme to a mixture of inhibitor (40µM, 20 µM, 10 µM, 5 µM, 1 µM ... | Chem Biol Drug Des 83: 498-506 (2014) Article DOI: 10.1111/cbdd.12265 BindingDB Entry DOI: 10.7270/Q2F76B65 | |||||||||||
More data for this Ligand-Target Pair |