Compile Data Set for Download or QSAR

Found 20 hits of ec50 for UniProtKB: P08683   

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
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496713 (CHEMBL1715624) Show SMILES COc1ccc(cc1CSc1ccc(NC(C)=O)cc1)C1Nc2cccc(O)c2C(=O)N1Cc1ccccc1 Show InChI InChI=1S/C31H29N3O4S/c1-20(35)32-24-12-14-25(15-13-24)39-19-23-17-22(11-16-28(23)38-2)30-33-26-9-6-10-27(36)29(26)31(37)34(30)18-21-7-4-3-5-8-21/h3-17,30,33,36H,18-19H2,1-2H3,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt 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
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496712 (CHEMBL1719708) Show SMILES COc1ccc(cc1CSc1ccc(NC(C)=O)cc1)C1Nc2ccccc2C(=O)N1Cc1ccccc1 Show InChI InChI=1S/C31H29N3O3S/c1-21(35)32-25-13-15-26(16-14-25)38-20-24-18-23(12-17-29(24)37-2)30-33-28-11-7-6-10-27(28)31(36)34(30)19-22-8-4-3-5-9-22/h3-18,30,33H,19-20H2,1-2H3,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	80	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496706 (CHEMBL1515891) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2cccc(O)c2C(=O)N1Cc1ccccc1 Show InChI InChI=1S/C31H29N3O5/c1-20(35)32-24-12-14-25(15-13-24)39-19-23-17-22(11-16-28(23)38-2)30-33-26-9-6-10-27(36)29(26)31(37)34(30)18-21-7-4-3-5-8-21/h3-17,30,33,36H,18-19H2,1-2H3,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	n/a	n/a	90	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496707 (CHEMBL1708839) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2cccc(F)c2C(=O)N1Cc1ccccc1 Show InChI InChI=1S/C31H28FN3O4/c1-20(36)33-24-12-14-25(15-13-24)39-19-23-17-22(11-16-28(23)38-2)30-34-27-10-6-9-26(32)29(27)31(37)35(30)18-21-7-4-3-5-8-21/h3-17,30,34H,18-19H2,1-2H3,(H,33,36)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	280	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496702 (CHEMBL1331194) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2ccccc2C(=O)N1Cc1ccccc1 Show InChI InChI=1S/C31H29N3O4/c1-21(35)32-25-13-15-26(16-14-25)38-20-24-18-23(12-17-29(24)37-2)30-33-28-11-7-6-10-27(28)31(36)34(30)19-22-8-4-3-5-9-22/h3-18,30,33H,19-20H2,1-2H3,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	290	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496715 (CHEMBL1705547) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2ccc(O)cc2C(=O)N1Cc1ccccc1 Show InChI InChI=1S/C31H29N3O5/c1-20(35)32-24-9-12-26(13-10-24)39-19-23-16-22(8-15-29(23)38-2)30-33-28-14-11-25(36)17-27(28)31(37)34(30)18-21-6-4-3-5-7-21/h3-17,30,33,36H,18-19H2,1-2H3,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	330	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496703 (CHEMBL1589735) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2ccccc2C(=O)N1CCc1ccccc1 Show InChI InChI=1S/C32H31N3O4/c1-22(36)33-26-13-15-27(16-14-26)39-21-25-20-24(12-17-30(25)38-2)31-34-29-11-7-6-10-28(29)32(37)35(31)19-18-23-8-4-3-5-9-23/h3-17,20,31,34H,18-19,21H2,1-2H3,(H,33,36)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	430	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496714 (CHEMBL1718442) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)-c1nc2cccc(O)c2c(=O)n1Cc1ccccc1 Show InChI InChI=1S/C31H27N3O5/c1-20(35)32-24-12-14-25(15-13-24)39-19-23-17-22(11-16-28(23)38-2)30-33-26-9-6-10-27(36)29(26)31(37)34(30)18-21-7-4-3-5-8-21/h3-17,36H,18-19H2,1-2H3,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	550	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496708 (CHEMBL1315387) Show SMILES CCCCN1C(Nc2ccccc2C1=O)c1ccc(OC)c(COc2ccc(NC(C)=O)cc2)c1 Show InChI InChI=1S/C28H31N3O4/c1-4-5-16-31-27(30-25-9-7-6-8-24(25)28(31)33)20-10-15-26(34-3)21(17-20)18-35-23-13-11-22(12-14-23)29-19(2)32/h6-15,17,27,30H,4-5,16,18H2,1-3H3,(H,29,32)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	830	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496705 (CHEMBL1370580) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)-c1nc2ccccc2c(=O)n1Cc1ccco1 Show InChI InChI=1S/C29H25N3O5/c1-19(33)30-22-10-12-23(13-11-22)37-18-21-16-20(9-14-27(21)35-2)28-31-26-8-4-3-7-25(26)29(34)32(28)17-24-6-5-15-36-24/h3-16H,17-18H2,1-2H3,(H,30,33)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	930	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496717 (CHEMBL1357440) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)-c1nc2ccccc2c(=O)n1Cc1ccccc1 Show InChI InChI=1S/C31H27N3O4/c1-21(35)32-25-13-15-26(16-14-25)38-20-24-18-23(12-17-29(24)37-2)30-33-28-11-7-6-10-27(28)31(36)34(30)19-22-8-4-3-5-9-22/h3-18H,19-20H2,1-2H3,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	960	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM83388 (MLS001073997 | N-[4-[5-[3-(2-furfuryl)-4-keto-1,2-...) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2ccccc2C(=O)N1Cc1ccco1 Show InChI InChI=1S/C29H27N3O5/c1-19(33)30-22-10-12-23(13-11-22)37-18-21-16-20(9-14-27(21)35-2)28-31-26-8-4-3-7-25(26)29(34)32(28)17-24-6-5-15-36-24/h3-16,28,31H,17-18H2,1-2H3,(H,30,33)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.16E+3	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496709 (CHEMBL1720417) Show SMILES CC(=O)Nc1ccc(OCc2cccc(c2)C2Nc3ccccc3C(=O)N2Cc2ccccc2)cc1 Show InChI InChI=1S/C30H27N3O3/c1-21(34)31-25-14-16-26(17-15-25)36-20-23-10-7-11-24(18-23)29-32-28-13-6-5-12-27(28)30(35)33(29)19-22-8-3-2-4-9-22/h2-18,29,32H,19-20H2,1H3,(H,31,34)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.86E+3	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496710 (CHEMBL1563670) Show SMILES COc1ccc(OCc2cc(ccc2OC)C2Nc3ccccc3C(=O)N2Cc2ccccc2)cc1 Show InChI InChI=1S/C30H28N2O4/c1-34-24-13-15-25(16-14-24)36-20-23-18-22(12-17-28(23)35-2)29-31-27-11-7-6-10-26(27)30(33)32(29)19-21-8-4-3-5-9-21/h3-18,29,31H,19-20H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.16E+3	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496711 (CHEMBL1729165) Show SMILES COc1ccc(cc1COc1ccccc1)C1Nc2ccccc2C(=O)N1Cc1ccccc1 Show InChI InChI=1S/C29H26N2O3/c1-33-27-17-16-22(18-23(27)20-34-24-12-6-3-7-13-24)28-30-26-15-9-8-14-25(26)29(32)31(28)19-21-10-4-2-5-11-21/h2-18,28,30H,19-20H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.57E+3	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496719 (CHEMBL1571865) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2ccccc2C(=O)N1Cc1ccncc1 Show InChI InChI=1S/C30H28N4O4/c1-20(35)32-24-8-10-25(11-9-24)38-19-23-17-22(7-12-28(23)37-2)29-33-27-6-4-3-5-26(27)30(36)34(29)18-21-13-15-31-16-14-21/h3-17,29,33H,18-19H2,1-2H3,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	3.98E+3	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496716 (CHEMBL1706950) Show SMILES COc1ccc(cc1COc1cccc(NC(C)=O)c1)C1Nc2ccccc2C(=O)N1Cc1ccccc1 Show InChI InChI=1S/C31H29N3O4/c1-21(35)32-25-11-8-12-26(18-25)38-20-24-17-23(15-16-29(24)37-2)30-33-28-14-7-6-13-27(28)31(36)34(30)19-22-9-4-3-5-10-22/h3-18,30,33H,19-20H2,1-2H3,(H,32,35)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.34E+3	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496718 (CHEMBL1473939) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2cccc(OC)c2C(=O)N1Cc1ccccc1 Show InChI InChI=1S/C32H31N3O5/c1-21(36)33-25-13-15-26(16-14-25)40-20-24-18-23(12-17-28(24)38-2)31-34-27-10-7-11-29(39-3)30(27)32(37)35(31)19-22-8-5-4-6-9-22/h4-18,31,34H,19-20H2,1-3H3,(H,33,36)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.48E+3	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50496704 (CHEMBL1701447) Show SMILES COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2ccccc2C(=O)N1c1ccccc1 Show InChI InChI=1S/C30H27N3O4/c1-20(34)31-23-13-15-25(16-14-23)37-19-22-18-21(12-17-28(22)36-2)29-32-27-11-7-6-10-26(27)30(35)33(29)24-8-4-3-5-9-24/h3-18,29,32H,19H2,1-2H3,(H,31,34)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	5.09E+3	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin) transiently transfected HEK-EM293 cells assessed as cAMP level after 1 hr by ELISA				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair
Cytochrome P450 2C11 (Rattus norvegicus)	BDBM50189778 (CHEMBL211405 | N-tert-butyl-5-amino-4-(3-methoxyph...) Show SMILES COc1cccc(c1)-c1nc(SC)nc2sc(C(=O)NC(C)(C)C)c(N)c12 Show InChI InChI=1S/C19H22N4O2S2/c1-19(2,3)23-16(24)15-13(20)12-14(10-7-6-8-11(9-10)25-4)21-18(26-5)22-17(12)27-15/h6-9H,20H2,1-5H3,(H,23,24)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a
NIH Chemical Genomics Center Curated by ChEMBL					Assay Description Agonist activity at TSHR (unknown origin)				Medchemcomm 2: 1016-1020 (2011) Article DOI: 10.1039/c1md00145k BindingDB Entry DOI: 10.7270/Q2668H51
					More data for this Ligand-Target Pair