BDBM55708 MLS000682559::N-[2-(4-ethyl-1-piperazinyl)ethyl]-4-[(E)-[4-[(2-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-ylidene]methyl]benzamide::N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-[(E)-[4-[(2-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-ylidene]methyl]benzamide::N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-[(E)-[4-[(2-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-ylidene]methyl]benzamide::N-[2-(4-ethylpiperazin-1-yl)ethyl]-4-{(E)-[4-(2-methylbenzyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}benzamide::N-[2-(4-ethylpiperazino)ethyl]-4-[(E)-[3-keto-4-(2-methylbenzyl)-1,4-benzothiazin-2-ylidene]methyl]benzamide::SMR000311916::cid_16189333
SMILES: CCN1CCN(CCNC(=O)c2ccc(\C=C3\Sc4ccccc4N(Cc4ccccc4C)C3=O)cc2)CC1
InChI Key: InChIKey=YOYUMQYGKMEWJR-JBASAIQMSA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
neutrophil cytosolic factor 1 (Homo sapiens (Human)) | BDBM55708 (MLS000682559 | N-[2-(4-ethyl-1-piperazinyl)ethyl]-...) | PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 3.81E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay | Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Susan Smith, Emory Univers... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2M90723 | |||||||||||
More data for this Ligand-Target Pair |