Compile Data Set for Download or QSAR

Found 14 hits of ec50 data for polymerid = 5269   

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
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM23927 (2,3,7,8-Tetrachlorodibenzo-p-dioxin | 2,3,7,8-tetr...) Show SMILES Clc1cc2Oc3cc(Cl)c(Cl)cc3Oc2cc1Cl Show InChI InChI=1S/C12H4Cl4O2/c13-5-1-9-10(2-6(5)14)18-12-4-8(16)7(15)3-11(12)17-9/h1-4H	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	0.0300	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Agonist activity at Ah receptor in genetically engineered mouse cells expressing firefly luciferase gene by CALUX transactivational assay				Bioorg Med Chem Lett 21: 6258-63 (2011) Article DOI: 10.1016/j.bmcl.2011.09.008 BindingDB Entry DOI: 10.7270/Q21836XD
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50602335 (CHEMBL5186309) Show SMILES [H][C@@]12Cc3cc(Cl)c(Br)cc3C(=O)N1CCc1ccccc21 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.0580	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c00956 BindingDB Entry DOI: 10.7270/Q2HM5DH2
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50506039 (CHEMBL1324296) Show SMILES COC(=O)c1csc(n1)C(=O)c1c[nH]c2ccccc12 Show InChI InChI=1S/C14H10N2O3S/c1-19-14(18)11-7-20-13(16-11)12(17)9-6-15-10-5-3-2-4-8(9)10/h2-7,15H,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c00208 BindingDB Entry DOI: 10.7270/Q27D3076
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50602335 (CHEMBL5186309) Show SMILES [H][C@@]12Cc3cc(Cl)c(Br)cc3C(=O)N1CCc1ccccc21 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	71	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c00956 BindingDB Entry DOI: 10.7270/Q2HM5DH2
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50015301 (CHEMBL3263111) Show SMILES Clc1ccc(-c2nc(no2)-c2ccccc2)c(Cl)c1 Show InChI InChI=1S/C14H8Cl2N2O/c15-10-6-7-11(12(16)8-10)14-17-13(18-19-14)9-4-2-1-3-5-9/h1-8H	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a
University of Utah Curated by ChEMBL					Assay Description Agonist activity at AHR in FVB/N mouse primary mammary epithelial cells assessed as blockade of mammary branching morphogenesis after 144 hrs by micr...				Bioorg Med Chem Lett 24: 2473-6 (2014) Article DOI: 10.1016/j.bmcl.2014.04.013 BindingDB Entry DOI: 10.7270/Q2C24Z0T
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50015302 (CHEMBL3263112) Show SMILES Nc1cc(Cl)ccc1-c1nc(no1)-c1ccccc1 Show InChI InChI=1S/C14H10ClN3O/c15-10-6-7-11(12(16)8-10)14-17-13(18-19-14)9-4-2-1-3-5-9/h1-8H,16H2	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a
University of Utah Curated by ChEMBL					Assay Description Agonist activity at AHR in FVB/N mouse primary mammary epithelial cells assessed as blockade of mammary branching morphogenesis after 144 hrs by micr...				Bioorg Med Chem Lett 24: 2473-6 (2014) Article DOI: 10.1016/j.bmcl.2014.04.013 BindingDB Entry DOI: 10.7270/Q2C24Z0T
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50015303 (CHEMBL3263118) Show SMILES [O-][N+](=O)c1cc(F)ccc1-c1nc(no1)-c1ccccc1 Show InChI InChI=1S/C14H8FN3O3/c15-10-6-7-11(12(8-10)18(19)20)14-16-13(17-21-14)9-4-2-1-3-5-9/h1-8H	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a
University of Utah Curated by ChEMBL					Assay Description Agonist activity at AHR in FVB/N mouse primary mammary epithelial cells assessed as blockade of mammary branching morphogenesis after 144 hrs by micr...				Bioorg Med Chem Lett 24: 2473-6 (2014) Article DOI: 10.1016/j.bmcl.2014.04.013 BindingDB Entry DOI: 10.7270/Q2C24Z0T
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50015304 (CHEMBL3263119) Show SMILES Nc1cc(ccc1-c1nc(no1)-c1ccccc1)C(F)(F)F Show InChI InChI=1S/C15H10F3N3O/c16-15(17,18)10-6-7-11(12(19)8-10)14-20-13(21-22-14)9-4-2-1-3-5-9/h1-8H,19H2	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a
University of Utah Curated by ChEMBL					Assay Description Agonist activity at AHR in FVB/N mouse primary mammary epithelial cells assessed as blockade of mammary branching morphogenesis after 144 hrs by micr...				Bioorg Med Chem Lett 24: 2473-6 (2014) Article DOI: 10.1016/j.bmcl.2014.04.013 BindingDB Entry DOI: 10.7270/Q2C24Z0T
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50357344 (CHEMBL1916902) Show SMILES CN(C)C\C=C\C(=O)N(C)c1ccc2nc(Oc3ccc(F)cc3C)c3cncn3c2c1 Show InChI InChI=1S/C24H24FN5O2/c1-16-12-17(25)7-10-22(16)32-24-21-14-26-15-30(21)20-13-18(8-9-19(20)27-24)29(4)23(31)6-5-11-28(2)3/h5-10,12-15H,11H2,1-4H3/b6-5+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Agonist activity at Ah receptor in genetically engineered mouse cells expressing firefly luciferase gene by CALUX transactivational assay				Bioorg Med Chem Lett 21: 6258-63 (2011) Article DOI: 10.1016/j.bmcl.2011.09.008 BindingDB Entry DOI: 10.7270/Q21836XD
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50357339 (CHEMBL1916897) Show SMILES CN(C)C\C=C\C(=O)N(C)c1cc2c(cc1Cl)nc(Nc1cc(F)ccc1C)c1cncn21 Show InChI InChI=1S/C24H24ClFN6O/c1-15-7-8-16(26)10-18(15)28-24-22-13-27-14-32(22)21-12-20(17(25)11-19(21)29-24)31(4)23(33)6-5-9-30(2)3/h5-8,10-14H,9H2,1-4H3,(H,28,29)/b6-5+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Agonist activity at Ah receptor in genetically engineered mouse cells expressing firefly luciferase gene by CALUX transactivational assay				Bioorg Med Chem Lett 21: 6258-63 (2011) Article DOI: 10.1016/j.bmcl.2011.09.008 BindingDB Entry DOI: 10.7270/Q21836XD
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50357322 (CHEMBL1916880) Show SMILES CN(C)C\C=C\C(=O)N(C)c1ccc2nc(Nc3cc(F)ccc3C)c3cncn3c2c1 Show InChI InChI=1S/C24H25FN6O/c1-16-7-8-17(25)12-20(16)28-24-22-14-26-15-31(22)21-13-18(9-10-19(21)27-24)30(4)23(32)6-5-11-29(2)3/h5-10,12-15H,11H2,1-4H3,(H,27,28)/b6-5+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Agonist activity at Ah receptor in genetically engineered mouse cells expressing firefly luciferase gene by CALUX transactivational assay				Bioorg Med Chem Lett 21: 6258-63 (2011) Article DOI: 10.1016/j.bmcl.2011.09.008 BindingDB Entry DOI: 10.7270/Q21836XD
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50015305 (CHEMBL3263120) Show SMILES Clc1ccc(-c2nc(no2)-c2ccccc2)c(Cl)c1Cl Show InChI InChI=1S/C14H7Cl3N2O/c15-10-7-6-9(11(16)12(10)17)14-18-13(19-20-14)8-4-2-1-3-5-8/h1-7H	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of Utah Curated by ChEMBL					Assay Description Agonist activity at AHR in FVB/N mouse primary mammary epithelial cells assessed as blockade of mammary branching morphogenesis after 144 hrs by micr...				Bioorg Med Chem Lett 24: 2473-6 (2014) Article DOI: 10.1016/j.bmcl.2014.04.013 BindingDB Entry DOI: 10.7270/Q2C24Z0T
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50357333 (CHEMBL1916891) Show SMILES CN(C)C\C=C\C(=O)N(C)c1cc2c(cc1F)nc(Nc1ccccc1C)c1cncn21 Show InChI InChI=1S/C24H25FN6O/c1-16-8-5-6-9-18(16)27-24-22-14-26-15-31(22)21-13-20(17(25)12-19(21)28-24)30(4)23(32)10-7-11-29(2)3/h5-10,12-15H,11H2,1-4H3,(H,27,28)/b10-7+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Agonist activity at Ah receptor in genetically engineered mouse cells expressing firefly luciferase gene by CALUX transactivational assay				Bioorg Med Chem Lett 21: 6258-63 (2011) Article DOI: 10.1016/j.bmcl.2011.09.008 BindingDB Entry DOI: 10.7270/Q21836XD
					More data for this Ligand-Target Pair
Aryl hydrocarbon receptor (Mus musculus (Mouse))	BDBM50239186 (1,1-Bis(3''-Indolyl)Methane | 3,3''-Diindolylmetha...) Show SMILES C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12 Show InChI InChI=1S/C17H14N2/c1-3-7-16-14(5-1)12(10-18-16)9-13-11-19-17-8-4-2-6-15(13)17/h1-8,10-11,18-19H,9H2	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	7.80E+4	n/a	n/a	n/a	n/a
University of Perugia Curated by ChEMBL					Assay Description Displacement of 2-azido-3-[125I]7,8-dibromodibenzo-pdioxin from C57BL/6J mouse liver AhR relative to TCDD				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111842 BindingDB Entry DOI: 10.7270/Q2N019SX
					More data for this Ligand-Target Pair