Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Retinoic acid receptor RXR-alpha [225-462]/Thyroid hormone receptor beta [148-410]' and Ligand = 'BDBM50012918'   

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
Retinoic acid receptor RXR-alpha [225-462]/Thyroid hormone receptor beta [148-410] (Homo sapiens (Human))	BDBM50012918 (CHEMBL3261324 | USRE46024, 6) Show SMILES CC(C)c1cc(Oc2c(Cl)cc(NCC(O)=O)cc2Cl)n[nH]c1=O Show InChI InChI=1S/C15H15Cl2N3O4/c1-7(2)9-5-12(19-20-15(9)23)24-14-10(16)3-8(4-11(14)17)18-6-13(21)22/h3-5,7,18H,6H2,1-2H3,(H,20,23)(H,21,22)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	US Patent	n/a	n/a	n/a	n/a	666	n/a	n/a	7.0	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Thirty microliters of H6-TRβ (50 nM) in 50 mM Hepes, pH 7.0, 1 mM DTT, 0.05% NP40 and 0.2 mg/ml BSA (Binding Buffer) was mixed with an equal vol...				US Patent USRE46024 (2016) BindingDB Entry DOI: 10.7270/Q24X56PH
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