Compile Data Set for Download or QSAR

Found 8 hits of ec50 data for polymerid = 50007417   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Vitamin D3 receptor A (Danio rerio)	BDBM50241974 (CHEMBL4099875) Show SMILES [H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@@H](O)C1=C)[C@H](C)CCCC(C)(C)O |r| Show InChI InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,23-,24+,25-,27-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.140	n/a	n/a	n/a	n/a
IGBMC (Institute of Genetics and of Molecular and Cellular Biology) Curated by ChEMBL					Assay Description Agonist activity at zebrafish VDR LBD (156 to 453 residues) expressed in HEK293 EBNA cells harboring human CYP24-Tk-Luc plasmid assessed as induction...				Eur J Med Chem 134: 86-96 (2017) Article DOI: 10.1016/j.ejmech.2017.03.081 BindingDB Entry DOI: 10.7270/Q2N018QM
					More data for this Ligand-Target Pair
Vitamin D3 receptor A (Danio rerio)	BDBM50496700 (CHEMBL3220717) Show SMILES [H][C@@]1([#6]-[#6][C@@]2([H])\[#6](-[#6]-[#6]-[#6][C@]12[#6])=[#6]\[#6]=[#6]-1\[#6]-[#6@H](-[#8])-[#6]-[#6@@H](-[#8])-[#6]-1)[#6@@H](-[#6]-[#6]-[#6]C([#8])(C([2H])([2H])[2H])C([2H])([2H])[2H])-[#6]C#CC([#8])(C(F)(F)F)C(F)(F)F |r| Show InChI InChI=1S/C31H44F6O4/c1-27(2,40)14-4-7-21(9-6-16-29(41,30(32,33)34)31(35,36)37)25-12-13-26-22(8-5-15-28(25,26)3)11-10-20-17-23(38)19-24(39)18-20/h10-11,21,23-26,38-41H,4-5,7-9,12-15,17-19H2,1-3H3/b22-11+/t21-,23-,24-,25+,26-,28+/m0/s1/i1D3,2D3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.150	n/a	n/a	n/a	n/a
Centre National de la Recherche Scientifique Curated by ChEMBL					Assay Description Agonist activity at zebrafish gal4-VDR LBD expressed in human MCF7 cells by luciferase reporter gene based transactivation assay				Medchemcomm 2: 424-429 (2011) Article DOI: 10.1039/c1md00059d BindingDB Entry DOI: 10.7270/Q29W0JFT
					More data for this Ligand-Target Pair
Vitamin D3 receptor A (Danio rerio)	BDBM50496701 (CHEMBL3220718) Show SMILES [H][C@@]1([#6]-[#6][C@@]2([H])\[#6](-[#6]-[#6]-[#6][C@]12[#6])=[#6]\[#6]=[#6]-1\[#6]-[#6@H](-[#8])-[#6]-[#6@@H](-[#8])-[#6]-1)[#6@H](-[#6]-[#6]-[#6]C([#8])(C([2H])([2H])[2H])C([2H])([2H])[2H])-[#6]C#CC([#8])(C(F)(F)F)C(F)(F)F |r| Show InChI InChI=1S/C31H44F6O4/c1-27(2,40)14-4-7-21(9-6-16-29(41,30(32,33)34)31(35,36)37)25-12-13-26-22(8-5-15-28(25,26)3)11-10-20-17-23(38)19-24(39)18-20/h10-11,21,23-26,38-41H,4-5,7-9,12-15,17-19H2,1-3H3/b22-11+/t21-,23+,24+,25-,26+,28-/m1/s1/i1D3,2D3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.25	n/a	n/a	n/a	n/a
Centre National de la Recherche Scientifique Curated by ChEMBL					Assay Description Agonist activity at zebrafish gal4-VDR LBD expressed in human MCF7 cells by luciferase reporter gene based transactivation assay				Medchemcomm 2: 424-429 (2011) Article DOI: 10.1039/c1md00059d BindingDB Entry DOI: 10.7270/Q29W0JFT
					More data for this Ligand-Target Pair
Vitamin D3 receptor A (Danio rerio)	BDBM50496699 (CHEMBL3220716) Show SMILES [H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1\C[C@H](O)C[C@@H](O)C1=C)C(CCCC(C)(C)O)CCCC(C)(C)O |r| Show InChI InChI=1S/C32H54O4/c1-22-25(20-26(33)21-29(22)34)14-13-24-12-9-19-32(6)27(15-16-28(24)32)23(10-7-17-30(2,3)35)11-8-18-31(4,5)36/h13-14,23,26-29,33-36H,1,7-12,15-21H2,2-6H3/b24-13+,25-14-/t26-,27+,28-,29+,32+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.20	n/a	n/a	n/a	n/a
Centre National de la Recherche Scientifique Curated by ChEMBL					Assay Description Agonist activity at zebrafish gal4-VDR LBD expressed in human MCF7 cells by luciferase reporter gene based transactivation assay				Medchemcomm 2: 424-429 (2011) Article DOI: 10.1039/c1md00059d BindingDB Entry DOI: 10.7270/Q29W0JFT
					More data for this Ligand-Target Pair
Vitamin D3 receptor A (Danio rerio)	BDBM50200182 ((1S,3R,5Z,7E)-9,10-secocholesta-5,7,10(19)-triene-...) Show SMILES C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@H](O)C1=C |r| Show InChI InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,23-,24+,25+,27-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	n/a	5.5	n/a	n/a	n/a	n/a
Centre National de la Recherche Scientifique Curated by ChEMBL					Assay Description Agonist activity at zebrafish gal4-VDR LBD expressed in human MCF7 cells by luciferase reporter gene based transactivation assay				Medchemcomm 2: 424-429 (2011) Article DOI: 10.1039/c1md00059d BindingDB Entry DOI: 10.7270/Q29W0JFT
					More data for this Ligand-Target Pair				3D Structure (crystal)
Vitamin D3 receptor A (Danio rerio)	BDBM50241976 (CHEMBL4088053) Show SMILES [H][C@]1(CC[C@@H](O1)C(C)(C)O)[C@@H](C)[C@@]1([H])CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@@H](O)C1=C |r| Show InChI InChI=1S/C28H44O4/c1-17-20(15-21(29)16-24(17)30)9-8-19-7-6-14-28(5)22(10-11-23(19)28)18(2)25-12-13-26(32-25)27(3,4)31/h8-9,18,21-26,29-31H,1,6-7,10-16H2,2-5H3/b19-8+,20-9-/t18-,21+,22+,23-,24+,25-,26+,28+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>100	n/a	n/a	n/a	n/a
IGBMC (Institute of Genetics and of Molecular and Cellular Biology) Curated by ChEMBL					Assay Description Agonist activity at zebrafish VDR LBD (156 to 453 residues) expressed in HEK293 EBNA cells harboring human CYP24-Tk-Luc plasmid assessed as induction...				Eur J Med Chem 134: 86-96 (2017) Article DOI: 10.1016/j.ejmech.2017.03.081 BindingDB Entry DOI: 10.7270/Q2N018QM
					More data for this Ligand-Target Pair
Vitamin D3 receptor A (Danio rerio)	BDBM50241975 (CHEMBL4060864) Show SMILES [H][C@]1(CC[C@H](O1)C(C)(C)O)[C@@H](C)[C@@]1([H])CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@@H](O)C1=C |r| Show InChI InChI=1S/C28H44O4/c1-17-20(15-21(29)16-24(17)30)9-8-19-7-6-14-28(5)22(10-11-23(19)28)18(2)25-12-13-26(32-25)27(3,4)31/h8-9,18,21-26,29-31H,1,6-7,10-16H2,2-5H3/b19-8+,20-9-/t18-,21+,22+,23-,24+,25-,26-,28+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>100	n/a	n/a	n/a	n/a
IGBMC (Institute of Genetics and of Molecular and Cellular Biology) Curated by ChEMBL					Assay Description Agonist activity at zebrafish VDR LBD (156 to 453 residues) expressed in HEK293 EBNA cells harboring human CYP24-Tk-Luc plasmid assessed as induction...				Eur J Med Chem 134: 86-96 (2017) Article DOI: 10.1016/j.ejmech.2017.03.081 BindingDB Entry DOI: 10.7270/Q2N018QM
					More data for this Ligand-Target Pair
Vitamin D3 receptor A (Danio rerio)	BDBM50241977 (CHEMBL4066758) Show SMILES [H][C@@]1(CC[C@H](O1)C(C)(C)O)[C@@H](C)[C@@]1([H])CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@@H](O)C1=C |r| Show InChI InChI=1S/C28H44O4/c1-17-20(15-21(29)16-24(17)30)9-8-19-7-6-14-28(5)22(10-11-23(19)28)18(2)25-12-13-26(32-25)27(3,4)31/h8-9,18,21-26,29-31H,1,6-7,10-16H2,2-5H3/b19-8+,20-9-/t18-,21+,22+,23-,24+,25+,26-,28+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>100	n/a	n/a	n/a	n/a
IGBMC (Institute of Genetics and of Molecular and Cellular Biology) Curated by ChEMBL					Assay Description Agonist activity at zebrafish VDR LBD (156 to 453 residues) expressed in HEK293 EBNA cells harboring human CYP24-Tk-Luc plasmid assessed as induction...				Eur J Med Chem 134: 86-96 (2017) Article DOI: 10.1016/j.ejmech.2017.03.081 BindingDB Entry DOI: 10.7270/Q2N018QM
					More data for this Ligand-Target Pair