Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Major surface glycoprotein G' and Ligand = 'BDBM194744'   

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
Major surface glycoprotein G (Human respiratory syncytial virus A (strain Long))	BDBM194744 (US9670211, 2-12 ) Show SMILES OC(=O)[C@H]1CC[C@H](CC1)n1c(CN2C(=O)C3(CC3)c3ccncc23)nc2cc(Cl)ccc12 |r,wD:6.9,3.2,(2.43,6.38,;.94,5.98,;-.15,7.07,;.54,4.5,;-.94,4.1,;-1.34,2.61,;-.25,1.52,;1.23,1.92,;1.63,3.41,;-.65,.03,;.25,-1.21,;1.79,-1.21,;2.56,-2.55,;4.1,-2.55,;4.87,-1.21,;4.58,-4.01,;5.35,-5.34,;6.12,-4.01,;3.33,-4.92,;3.17,-6.45,;1.76,-7.07,;.52,-6.17,;.68,-4.64,;2.09,-4.01,;-.65,-2.46,;-2.12,-1.98,;-3.45,-2.75,;-4.78,-1.98,;-6.12,-2.75,;-4.78,-.44,;-3.45,.33,;-2.12,-.44,)| Show InChI InChI=1S/C24H23ClN4O3/c25-15-3-6-19-18(11-15)27-21(29(19)16-4-1-14(2-5-16)22(30)31)13-28-20-12-26-10-7-17(20)24(8-9-24)23(28)32/h3,6-7,10-12,14,16H,1-2,4-5,8-9,13H2,(H,30,31)/t14-,16+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
HOFFMANN-LA ROCHE INC. US Patent					Assay Description To measure anti-RSV activity of compounds, 96-well plates are seeded with 6×103 cells per well in Dulbecco's modified Eagle's medium (DMEM) c...				US Patent US9670211 (2017) BindingDB Entry DOI: 10.7270/Q2C827GQ
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