Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neutrophil cytosol factor 1 [S99G]' and Ligand = 'BDBM55838'   

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))	BDBM55838 (MLS000562851 | SMR000391154 | YW-YW | cid_16196616) Show SMILES Cl.NC(Cc1ccc(O)cc1)c1cn(nn1)C(Cc1cc2ccccc2[nH]1)C(=O)N1CCN(CC1)c1nc(NCCOCCOCCOCC#C)nc(n1)N1CCN(CC1)C(=O)C(Cc1cc2ccccc2[nH]1)n1cc(nn1)C(N)Cc1ccc(O)cc1 Show InChI InChI=1S/C62H72N18O7.ClH/c1-2-28-85-30-32-87-33-31-86-29-19-65-60-68-61(77-24-20-75(21-25-77)58(83)56(38-46-36-44-7-3-5-9-52(44)66-46)79-40-54(71-73-79)50(63)34-42-11-15-48(81)16-12-42)70-62(69-60)78-26-22-76(23-27-78)59(84)57(39-47-37-45-8-4-6-10-53(45)67-47)80-41-55(72-74-80)51(64)35-43-13-17-49(82)18-14-43;/h1,3-18,36-37,40-41,50-51,56-57,66-67,81-82H,19-35,38-39,63-64H2,(H,65,68,69,70);1H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.55E+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