Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 102730   

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
Tumor necrosis factor (Homo sapiens (Human))	BDBM102730 (US8541572, 1901) Show SMILES CCN1CCN(CC1)C(=O)C1CCC(=O)N1c1ccc(cc1)C#C[C@]1(CN2Cc3ccc(OC)cc3C2=O)NC(=O)NC1=O |r| Show InChI InChI=1S/C32H34N6O6/c1-3-35-14-16-36(17-15-35)29(41)26-10-11-27(39)38(26)23-7-4-21(5-8-23)12-13-32(30(42)33-31(43)34-32)20-37-19-22-6-9-24(44-2)18-25(22)28(37)40/h4-9,18,26H,3,10-11,14-17,19-20H2,1-2H3,(H2,33,34,42,43)/t26?,32-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.130	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Inhibition assay using TNF-alpha.				US Patent US8541572 (2013) BindingDB Entry DOI: 10.7270/Q2QC024J
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