BDBM43004 2-[[5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3-isoxazoline-3-carbonyl]amino]benzoic acid methyl ester::2-[[oxo-[5-(4-oxo-1-cyclohexa-2,5-dienylidene)-2H-isoxazol-3-yl]methyl]amino]benzoic acid methyl ester::MLS000522877::SMR000128143::cid_9551347::methyl 2-[[5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2H-1,2-oxazol-3-yl]carbonylamino]benzoate::methyl 2-[[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-2H-1,2-oxazole-3-carbonyl]amino]benzoate
SMILES: COC(=O)c1ccccc1NC(=O)c1cc(on1)-c1ccc(O)cc1
InChI Key: InChIKey=MLNPWHJBBFIFID-UHFFFAOYSA-N
Data: 3 EC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Nuclear receptor coactivator 1 (Homo sapiens (Human)) | BDBM43004 (2-[[5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3-isoxa...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 2.49E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2FT8JGV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nuclear receptor coactivator 2 (Homo sapiens (Human)) | BDBM43004 (2-[[5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3-isoxa...) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 3.15E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2QZ28CS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nuclear receptor coactivator 3 (Homo sapiens (Human)) | BDBM43004 (2-[[5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3-isoxa...) | Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 3.36E+4 | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center http://molscreen.florida.scripps.edu/ Center Affiliation: The ... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2707ZV7 | |||||||||||
More data for this Ligand-Target Pair |