Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neutrophil cytosol factor 1 [S99G]' and Ligand = 'BDBM55708'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neutrophil cytosol factor 1 [S99G] (Homo sapiens (Human))	BDBM55708 (MLS000682559 | N-[2-(4-ethyl-1-piperazinyl)ethyl]-...) Show SMILES CCN1CCN(CCNC(=O)c2ccc(\C=C3\Sc4ccccc4N(Cc4ccccc4C)C3=O)cc2)CC1 Show InChI InChI=1S/C32H36N4O2S/c1-3-34-18-20-35(21-19-34)17-16-33-31(37)26-14-12-25(13-15-26)22-30-32(38)36(23-27-9-5-4-8-24(27)2)28-10-6-7-11-29(28)39-30/h4-15,22H,3,16-21,23H2,1-2H3,(H,33,37)/b30-22+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt 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
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