BDBM43042 2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-6-phenyl-pyridine-3-carbonitrile::2-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-6-phenylpyridine-3-carbonitrile::2-[[2-keto-2-(2-ketochromen-3-yl)ethyl]thio]-6-phenyl-nicotinonitrile::2-[[2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl]thio]-6-phenyl-3-pyridinecarbonitrile::2-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}-6-phenylnicotinonitrile::MLS000544625::SMR000162928::cid_979025
SMILES: O=C(CSc1nc(ccc1C#N)-c1ccccc1)c1cc2ccccc2oc1=O
InChI Key: InChIKey=PSHLFTMJJZRDTR-UHFFFAOYSA-N
Data: 5 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 isoform 1 (Homo sapiens (Human)) | BDBM43042 (2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | PCBioAssay | n/a | n/a | n/a | n/a | 1.55E+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 3 isoform a (Homo sapiens (Human)) | BDBM43042 (2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)...) | Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | PCBioAssay | n/a | n/a | n/a | n/a | 1.64E+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 | |||||||||||||
mRNA interferase toxin, antitoxin is MazE (Escherichia coli str. K-12 substr. MG1655) | BDBM43042 (2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | PCBioAssay | n/a | n/a | n/a | n/a | >9.90E+4 | 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/Q2TB15DB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
mRNA interferase toxin, antitoxin is MazE (Escherichia coli str. K-12 substr. MG1655) | BDBM43042 (2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | PCBioAssay | n/a | n/a | n/a | n/a | >9.90E+4 | 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/Q2Z31X54 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
NCOA2 protein (Homo sapiens (Human)) | BDBM43042 (2-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)...) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | PCBioAssay | n/a | n/a | n/a | n/a | 1.37E+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 |