Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tumor necrosis factor' and Ligand = 'BDBM296842'   

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))	BDBM296842 (2-(4-(1-(2,5-Dimethylphenyl)-1,2,3,4-tetrahydroimi...) Show SMILES Cc1nnc(o1)-c1ccc(cc1)-c1ccc2nc3CCCN(c3n2c1)c1cc(C)ccc1C Show InChI InChI=1S/C27H25N5O/c1-17-6-7-18(2)24(15-17)31-14-4-5-23-27(31)32-16-22(12-13-25(32)28-23)20-8-10-21(11-9-20)26-30-29-19(3)33-26/h6-13,15-16H,4-5,14H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Test compounds serially diluted in DMSO were plated in an assay plate (Labcyte, Cat. #LP-0200) at final concentrations ranging from 0.004 μM to ...				US Patent US10112944 (2018) BindingDB Entry DOI: 10.7270/Q2NG4SPB
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