Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Retinoic acid receptor alpha' and Ligand = 'BDBM50290079'   

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 alpha (Homo sapiens (Human))	BDBM50290079 (3-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-naphthal...) Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)C1COc2cc(ccc2C1)C(O)=O Show InChI InChI=1S/C24H28O3/c1-23(2)9-10-24(3,4)20-12-15(7-8-19(20)23)18-11-16-5-6-17(22(25)26)13-21(16)27-14-18/h5-8,12-13,18H,9-11,14H2,1-4H3,(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	5.79E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity towards Retinoic acid receptor alpha				Bioorg Med Chem Lett 7: 2289-2294 (1997) Article DOI: 10.1016/S0960-894X(97)00405-8 BindingDB Entry DOI: 10.7270/Q2HD7W4M
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