BDBM83276 MLS002702141::SMR001565706::[(1E,3E)-4-(benzenesulfonyl)buta-1,3-dienyl]sulfonylbenzene::[(1E,3E)-4-(phenylsulfonyl)buta-1,3-dienyl]sulfonylbenzene::[(1E,3E)-4-besylbuta-1,3-dienyl]sulfonylbenzene::cid_5468033
SMILES: O=S(=O)(\C=C\C=C\S(=O)(=O)c1ccccc1)c1ccccc1
InChI Key: InChIKey=DEXCOBKOWPYHFL-FNCQTZNRSA-N
Data: 3 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Beta lactamase (Pseudomonas aeruginosa) | BDBM83276![]() (MLS002702141 | SMR001565706 | [(1E,3E)-4-(benzenes...) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar | PC cid PC sid UniChem | Article PCBioAssay | n/a | n/a | >4.98E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa... | PubChem Bioassay (2011) Article DOI: 10.1021/bi500887n BindingDB Entry DOI: 10.7270/Q2G15ZB8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Toll-like receptor 9 (TLR9) (Homo sapiens (Human)) | BDBM83276![]() (MLS002702141 | SMR001565706 | [(1E,3E)-4-(benzenes...) | UniProtKB/SwissProt GoogleScholar | PC cid PC sid UniChem | PCBioAssay | n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q25Q4TQ8 | ||||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Toll-like receptor 9 (TLR9) (Homo sapiens (Human)) | BDBM83276![]() (MLS002702141 | SMR001565706 | [(1E,3E)-4-(benzenes...) | UniProtKB/SwissProt GoogleScholar | PC cid PC sid UniChem | Article PCBioAssay | n/a | n/a | 8.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa... | PubChem Bioassay (2011) Article DOI: 10.1021/bi500711x BindingDB Entry DOI: 10.7270/Q2KS6Q2P | |||||||||||
More data for this Ligand-Target Pair |