Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Retinoic acid receptor RXR-alpha' and Ligand = 'BDBM50218496'   

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))	BDBM50218496 (4-[5,7,7,10,10-pentamethyl-2-((E)-2-phenyl-ethenes...) Show SMILES CN1c2ccc(NS(=O)(=O)\C=C\c3ccccc3)cc2N=C(c2ccc(cc2)C(O)=O)c2cc3c(cc12)C(C)(C)CCC3(C)C |t:22| Show InChI InChI=1S/C37H37N3O4S/c1-36(2)18-19-37(3,4)30-23-33-28(22-29(30)36)34(25-11-13-26(14-12-25)35(41)42)38-31-21-27(15-16-32(31)40(33)5)39-45(43,44)20-17-24-9-7-6-8-10-24/h6-17,20-23,39H,18-19H2,1-5H3,(H,41,42)/b20-17+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human RXRalpha expressed in EK293 cells assessed as inhibition of 9-cis-retinoic acid-induced transactivation				Bioorg Med Chem Lett 17: 4808-11 (2007) Article DOI: 10.1016/j.bmcl.2007.06.079 BindingDB Entry DOI: 10.7270/Q2V40TWB
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50218496 (4-[5,7,7,10,10-pentamethyl-2-((E)-2-phenyl-ethenes...) Show SMILES CN1c2ccc(NS(=O)(=O)\C=C\c3ccccc3)cc2N=C(c2ccc(cc2)C(O)=O)c2cc3c(cc12)C(C)(C)CCC3(C)C |t:22| Show InChI InChI=1S/C37H37N3O4S/c1-36(2)18-19-37(3,4)30-23-33-28(22-29(30)36)34(25-11-13-26(14-12-25)35(41)42)38-31-21-27(15-16-32(31)40(33)5)39-45(43,44)20-17-24-9-7-6-8-10-24/h6-17,20-23,39H,18-19H2,1-5H3,(H,41,42)/b20-17+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Antagonist activity at human RXRalpha expressed in EK293 cells assessed as inhibition of LG100268-induced transactivation				Bioorg Med Chem Lett 17: 4808-11 (2007) Article DOI: 10.1016/j.bmcl.2007.06.079 BindingDB Entry DOI: 10.7270/Q2V40TWB
					More data for this Ligand-Target Pair