Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Interleukin-1 receptor-associated kinase 4' and Ligand = 'BDBM647522'   

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
Interleukin-1 receptor-associated kinase 4 (Homo sapiens (Human))	BDBM647522 (US20240025893, Example b-04-48) Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1ccncc1Cl |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-7.64,-2.25,;-8.41,-.92,;-9.96,-.92,;-10.72,.41,;-9.96,1.75,;-8.41,1.75,;-7.64,.41,;-6.1,.41,;-5.01,1.5,;-3.92,.41,;-5.01,-.68,;-2.38,.41,;-1.61,-.92,;-1.61,1.75,;-.07,1.75,;.83,2.99,;2.3,2.52,;3.63,3.29,;4.97,2.52,;4.97,.98,;3.63,.21,;2.3,.98,;.83,.5,;6.3,.21,;6.3,-1.33,;7.63,-2.1,;8.97,-1.33,;10.3,-2.1,;11.63,-1.33,;12.97,-2.1,;14.43,-1.63,;15.34,-2.87,;14.43,-4.12,;12.97,-3.64,;11.63,-4.41,;8.97,.21,;7.63,.98,;-12.26,.41,;-13.03,-.92,;-13.03,1.75,;-12.26,3.08,;-13.03,4.41,;-14.57,4.41,;-15.34,3.08,;-14.57,1.75,;-15.34,.41,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.520	n/a	n/a	n/a	n/a	n/a	n/a
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