Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Retinoic acid receptor RXR-alpha' and Ligand = 'BDBM50032672'   

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 (Homo sapiens (Human))	BDBM50032672 (4-[1-(3,8,8-Trimethyl-5,6,7,8-tetrahydro-naphthale...) Show SMILES Cc1cc2CCCC(C)(C)c2cc1C(=C)c1ccc(cc1)C(O)=O Show InChI InChI=1S/C22H24O2/c1-14-12-18-6-5-11-22(3,4)20(18)13-19(14)15(2)16-7-9-17(10-8-16)21(23)24/h7-10,12-13H,2,5-6,11H2,1,3-4H3,(H,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Ability to bind directly to Retinoic acid receptor RXR-alpha was evaluated in a competitive binding assay.				J Med Chem 38: 3146-55 (1995) BindingDB Entry DOI: 10.7270/Q2542MMT
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50032672 (4-[1-(3,8,8-Trimethyl-5,6,7,8-tetrahydro-naphthale...) Show SMILES Cc1cc2CCCC(C)(C)c2cc1C(=C)c1ccc(cc1)C(O)=O Show InChI InChI=1S/C22H24O2/c1-14-12-18-6-5-11-22(3,4)20(18)13-19(14)15(2)16-7-9-17(10-8-16)21(23)24/h7-10,12-13H,2,5-6,11H2,1,3-4H3,(H,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a
Department of Pharmaceutical Sciences, College of Pharmacy and Health Sciences , St. John's University , Queens , New York 11439 , United States. Curated by ChEMBL					Assay Description Agonist activity at RXRaplha (unknown origin)				J Med Chem 61: 2166-2210 (2018) Article DOI: 10.1021/acs.jmedchem.7b00315 BindingDB Entry DOI: 10.7270/Q2B56N68
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50032672 (4-[1-(3,8,8-Trimethyl-5,6,7,8-tetrahydro-naphthale...) Show SMILES Cc1cc2CCCC(C)(C)c2cc1C(=C)c1ccc(cc1)C(O)=O Show InChI InChI=1S/C22H24O2/c1-14-12-18-6-5-11-22(3,4)20(18)13-19(14)15(2)16-7-9-17(10-8-16)21(23)24/h7-10,12-13H,2,5-6,11H2,1,3-4H3,(H,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Ability to activate gene expression at Retinoic acid receptor RXR-alpha was evaluated in a cotransfection assay.				J Med Chem 38: 3146-55 (1995) BindingDB Entry DOI: 10.7270/Q2542MMT
					More data for this Ligand-Target Pair