Compile Data Set for Download or QSAR

Found 22 hits with Last Name = 'wagner' and Initial = 'ce'   

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))	BDBM50299277 (2-Fluoro-4-(1-(1,2,3,4-tetrahydro-1,1,4,4,6-pentam...) Show SMILES Cc1cc2c(cc1Cc1ccc(C(O)=O)c(F)c1)C(C)(C)CCC2(C)C Show InChI InChI=1S/C23H27FO2/c1-14-10-18-19(23(4,5)9-8-22(18,2)3)13-16(14)11-15-6-7-17(21(25)26)20(24)12-15/h6-7,10,12-13H,8-9,11H2,1-5H3,(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Displacement of [3H]-9-cis-retinoic acid form human RXRalpha expressed in human Caco2 cells after 16 hrs				J Med Chem 52: 5950-66 (2009) Article DOI: 10.1021/jm900496b BindingDB Entry DOI: 10.7270/Q2Q81D41
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50032675 (4-[1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaph...) Show SMILES Cc1cc2c(cc1C(=C)c1ccc(cc1)C(O)=O)C(C)(C)CCC2(C)C Show InChI InChI=1S/C24H28O2/c1-15-13-20-21(24(5,6)12-11-23(20,3)4)14-19(15)16(2)17-7-9-18(10-8-17)22(25)26/h7-10,13-14H,2,11-12H2,1,3-6H3,(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB Article PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Displacement of [3H]-9-cis-retinoic acid form human RXRalpha expressed in human Caco2 cells after 16 hrs				J Med Chem 52: 5950-66 (2009) Article DOI: 10.1021/jm900496b BindingDB Entry DOI: 10.7270/Q2Q81D41
					More data for this Ligand-Target Pair				3D Structure (crystal)
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50299279 (4-(1-(1,2,3,4-Tetrahydro-1,1,4,4,6-pentamethylnaph...) Show SMILES Cc1cc2c(cc1Cc1ccc(C(O)=O)c(c1)[N+]([O-])=O)C(C)(C)CCC2(C)C Show InChI InChI=1S/C23H27NO4/c1-14-10-18-19(23(4,5)9-8-22(18,2)3)13-16(14)11-15-6-7-17(21(25)26)20(12-15)24(27)28/h6-7,10,12-13H,8-9,11H2,1-5H3,(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 PubMed	81	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Displacement of [3H]-9-cis-retinoic acid form human RXRalpha expressed in human Caco2 cells after 16 hrs				J Med Chem 52: 5950-66 (2009) Article DOI: 10.1021/jm900496b BindingDB Entry DOI: 10.7270/Q2Q81D41
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50299278 (3-Fluoro-4-(1-(1,2,3,4-tetrahydro-1,1,4,4,6-pentam...) Show SMILES Cc1cc2c(cc1Cc1ccc(cc1F)C(O)=O)C(C)(C)CCC2(C)C Show InChI InChI=1S/C23H27FO2/c1-14-10-18-19(23(4,5)9-8-22(18,2)3)12-17(14)11-15-6-7-16(21(25)26)13-20(15)24/h6-7,10,12-13H,8-9,11H2,1-5H3,(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	161	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Displacement of [3H]-9-cis-retinoic acid form human RXRalpha expressed in human Caco2 cells after 16 hrs				J Med Chem 52: 5950-66 (2009) Article DOI: 10.1021/jm900496b BindingDB Entry DOI: 10.7270/Q2Q81D41
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50067040 (((E,E)-1,7-bis(4-hydroxy-3-methoxyphenyl)-1,6-hept...) Show SMILES COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O |w:12.11,5.4| Show InChI InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human VDR expressed in human HCT116 cells co-expressing VDRE assessed as XDR3 transcriptional activity after 24 hrs by luciferase...				Bioorg Med Chem 21: 693-702 (2013) Article DOI: 10.1016/j.bmc.2012.11.033 BindingDB Entry DOI: 10.7270/Q2VQ340D
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533804 (CHEMBL4574155) Show SMILES CCN(c1ccc2c(c1)C(C)(C)CCC2(C)C)c1ncc(cn1)C(O)=O Show InChI InChI=1S/C21H27N3O2/c1-6-24(19-22-12-14(13-23-19)18(25)26)15-7-8-16-17(11-15)21(4,5)10-9-20(16,2)3/h7-8,11-13H,6,9-10H2,1-5H3,(H,25,26)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	41	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50032675 (4-[1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaph...) Show SMILES Cc1cc2c(cc1C(=C)c1ccc(cc1)C(O)=O)C(C)(C)CCC2(C)C Show InChI InChI=1S/C24H28O2/c1-15-13-20-21(24(5,6)12-11-23(20,3)4)14-19(15)16(2)17-7-9-18(10-8-17)22(25)26/h7-10,13-14H,2,11-12H2,1,3-6H3,(H,25,26)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	52	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair				3D Structure (crystal)
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533806 (CHEMBL4476114) Show SMILES Cc1cc2c(cc1C(=C)c1ccc(cc1)S(O)(=O)=O)C(C)(C)CCC2(C)C Show InChI InChI=1S/C23H28O3S/c1-15-13-20-21(23(5,6)12-11-22(20,3)4)14-19(15)16(2)17-7-9-18(10-8-17)27(24,25)26/h7-10,13-14H,2,11-12H2,1,3-6H3,(H,24,25,26)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.82E+4	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533807 (CHEMBL4440825) Show SMILES CCN(c1cnc(cn1)C(O)=O)c1cc2c(cc1C)C(C)(C)CCC2(C)C Show InChI InChI=1S/C22H29N3O2/c1-7-25(19-13-23-17(12-24-19)20(26)27)18-11-16-15(10-14(18)2)21(3,4)8-9-22(16,5)6/h10-13H,7-9H2,1-6H3,(H,26,27)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	296	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533808 (CHEMBL4468317) Show SMILES CCN(c1ccc2c(c1)C(C)(C)CCC2(C)C)c1cnc(cn1)C(O)=O Show InChI InChI=1S/C21H27N3O2/c1-6-24(18-13-22-17(12-23-18)19(25)26)14-7-8-15-16(11-14)21(4,5)10-9-20(15,2)3/h7-8,11-13H,6,9-10H2,1-5H3,(H,25,26)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	364	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533809 (CHEMBL4547228) Show SMILES CCN(c1ccc(cc1)C(O)=O)c1cc2c(cc1C)C(C)(C)CCC2(C)C Show InChI InChI=1S/C24H31NO2/c1-7-25(18-10-8-17(9-11-18)22(26)27)21-15-20-19(14-16(21)2)23(3,4)12-13-24(20,5)6/h8-11,14-15H,7,12-13H2,1-6H3,(H,26,27)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	7.90	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50324896 (6-[N-Ethyl(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-...) Show SMILES CCN(c1ccc2c(c1)C(C)(C)CCC2(C)C)c1ccc(cn1)C(O)=O Show InChI InChI=1S/C22H28N2O2/c1-6-24(19-10-7-15(14-23-19)20(25)26)16-8-9-17-18(13-16)22(4,5)12-11-21(17,2)3/h7-10,13-14H,6,11-12H2,1-5H3,(H,25,26)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	14	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533810 (CHEMBL4560758) Show SMILES CCN(c1ccc(C(O)=O)c(F)c1)c1ccc2c(c1)C(C)(C)CCC2(C)C Show InChI InChI=1S/C23H28FNO2/c1-6-25(16-7-9-17(21(26)27)20(24)14-16)15-8-10-18-19(13-15)23(4,5)12-11-22(18,2)3/h7-10,13-14H,6,11-12H2,1-5H3,(H,26,27)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	126	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533811 (CHEMBL4475014) Show SMILES CCN(c1ccc(cc1)C(O)=O)c1ccc2c(c1)C(C)(C)CCC2(C)C Show InChI InChI=1S/C23H29NO2/c1-6-24(17-9-7-16(8-10-17)21(25)26)18-11-12-19-20(15-18)23(4,5)14-13-22(19,2)3/h7-12,15H,6,13-14H2,1-5H3,(H,25,26)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	143	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533812 (CHEMBL4545837) Show SMILES CCN(c1ncc(cn1)C(O)=O)c1cc2c(cc1C)C(C)(C)CCC2(C)C Show InChI InChI=1S/C22H29N3O2/c1-7-25(20-23-12-15(13-24-20)19(26)27)18-11-17-16(10-14(18)2)21(3,4)8-9-22(17,5)6/h10-13H,7-9H2,1-6H3,(H,26,27)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	18	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533813 (CHEMBL4476213) Show SMILES CCN(c1ccc(C(O)=O)c(F)c1)c1cc2c(cc1C)C(C)(C)CCC2(C)C Show InChI InChI=1S/C24H30FNO2/c1-7-26(16-8-9-17(22(27)28)20(25)13-16)21-14-19-18(12-15(21)2)23(3,4)10-11-24(19,5)6/h8-9,12-14H,7,10-11H2,1-6H3,(H,27,28)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	34	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533814 (CHEMBL4459731) Show SMILES CCN(c1ccc(cn1)C(O)=O)c1cc2c(cc1C)C(C)(C)CCC2(C)C Show InChI InChI=1S/C23H30N2O2/c1-7-25(20-9-8-16(14-24-20)21(26)27)19-13-18-17(12-15(19)2)22(3,4)10-11-23(18,5)6/h8-9,12-14H,7,10-11H2,1-6H3,(H,26,27)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	14	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50299277 (2-Fluoro-4-(1-(1,2,3,4-tetrahydro-1,1,4,4,6-pentam...) Show SMILES Cc1cc2c(cc1Cc1ccc(C(O)=O)c(F)c1)C(C)(C)CCC2(C)C Show InChI InChI=1S/C23H27FO2/c1-14-10-18-19(23(4,5)9-8-22(18,2)3)13-16(14)11-15-6-7-17(21(25)26)20(24)12-15/h6-7,10,12-13H,8-9,11H2,1-5H3,(H,25,26)	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	n/a	n/a	43	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human recombinant Gal4-tagged RXRalpha expressed in human Caco2 cells assessed as receptor homodimerization after 24 hrs by mamma...				J Med Chem 52: 5950-66 (2009) Article DOI: 10.1021/jm900496b BindingDB Entry DOI: 10.7270/Q2Q81D41
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50299278 (3-Fluoro-4-(1-(1,2,3,4-tetrahydro-1,1,4,4,6-pentam...) Show SMILES Cc1cc2c(cc1Cc1ccc(cc1F)C(O)=O)C(C)(C)CCC2(C)C Show InChI InChI=1S/C23H27FO2/c1-14-10-18-19(23(4,5)9-8-22(18,2)3)12-17(14)11-15-6-7-16(21(25)26)13-20(15)24/h6-7,10,12-13H,8-9,11H2,1-5H3,(H,25,26)	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	n/a	n/a	420	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human recombinant Gal4-tagged RXRalpha expressed in human Caco2 cells assessed as receptor homodimerization after 24 hrs by mamma...				J Med Chem 52: 5950-66 (2009) Article DOI: 10.1021/jm900496b BindingDB Entry DOI: 10.7270/Q2Q81D41
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50299279 (4-(1-(1,2,3,4-Tetrahydro-1,1,4,4,6-pentamethylnaph...) Show SMILES Cc1cc2c(cc1Cc1ccc(C(O)=O)c(c1)[N+]([O-])=O)C(C)(C)CCC2(C)C Show InChI InChI=1S/C23H27NO4/c1-14-10-18-19(23(4,5)9-8-22(18,2)3)13-16(14)11-15-6-7-17(21(25)26)20(12-15)24(27)28/h6-7,10,12-13H,8-9,11H2,1-5H3,(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 PubMed	n/a	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human recombinant Gal4-tagged RXRalpha expressed in human Caco2 cells assessed as receptor homodimerization after 24 hrs by mamma...				J Med Chem 52: 5950-66 (2009) Article DOI: 10.1021/jm900496b BindingDB Entry DOI: 10.7270/Q2Q81D41
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50032675 (4-[1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaph...) Show SMILES Cc1cc2c(cc1C(=C)c1ccc(cc1)C(O)=O)C(C)(C)CCC2(C)C Show InChI InChI=1S/C24H28O2/c1-15-13-20-21(24(5,6)12-11-23(20,3)4)14-19(15)16(2)17-7-9-18(10-8-17)22(25)26/h7-10,13-14H,2,11-12H2,1,3-6H3,(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	n/a	n/a	52	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human recombinant Gal4-tagged RXRalpha expressed in human Caco2 cells assessed as receptor homodimerization after 24 hrs by mamma...				J Med Chem 52: 5950-66 (2009) Article DOI: 10.1021/jm900496b BindingDB Entry DOI: 10.7270/Q2Q81D41
					More data for this Ligand-Target Pair				3D Structure (crystal)
Retinoic acid receptor RXR-alpha/RXR-beta/RXR-gamma (Homo sapiens (Human))	BDBM50533805 (CHEMBL4441103) Show SMILES Cc1cc2c(cc1C(=O)c1ccc(cc1)S(O)(=O)=O)C(C)(C)CCC2(C)C Show InChI InChI=1S/C22H26O4S/c1-14-12-18-19(22(4,5)11-10-21(18,2)3)13-17(14)20(23)15-6-8-16(9-7-15)27(24,25)26/h6-9,12-13H,10-11H2,1-5H3,(H,24,25,26)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>8.00E+4	n/a	n/a	n/a	n/a
Arizona State University Curated by ChEMBL					Assay Description Agonist activity at human RXR binding domain and activation domain expressed in human HCT116 cells assessed as rexinoid activity incubated for 24 hrs...				J Med Chem 59: 8924-8940 (2016) Article DOI: 10.1021/acs.jmedchem.6b00812 BindingDB Entry DOI: 10.7270/Q26M3B90
					More data for this Ligand-Target Pair