Compile Data Set for Download or QSAR

Found 31 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 1110   

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
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310087 (2-chloro-6-fluoro-N-[1-(3-trifluoromethylbenzenesu...) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1cnc2cnn(c2c1)S(=O)(=O)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C20H11ClF4N4O3S/c21-14-5-2-6-15(22)18(14)19(30)28-12-8-17-16(26-9-12)10-27-29(17)33(31,32)13-4-1-3-11(7-13)20(23,24)25/h1-10H,(H,28,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.88E+3	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310124 ((S)-2-phenyl-N-(5-(m-tolylsulfonyl)-5,6,7,8-tetrah...) Show SMILES C[C@H](C(=O)Nc1cnc2CCCN(c2c1)S(=O)(=O)c1cccc(C)c1)c1ccccc1 |r| Show InChI InChI=1S/C24H25N3O3S/c1-17-8-6-11-21(14-17)31(29,30)27-13-7-12-22-23(27)15-20(16-25-22)26-24(28)18(2)19-9-4-3-5-10-19/h3-6,8-11,14-16,18H,7,12-13H2,1-2H3,(H,26,28)/t18-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	414	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310089 (US10377768, Compound 3 | US9657033, Compound 3) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1cnc2cnn(c2c1)S(=O)(=O)c1cccc(c1)C#N Show InChI InChI=1S/C20H11ClFN5O3S/c21-15-5-2-6-16(22)19(15)20(28)26-13-8-18-17(24-10-13)11-25-27(18)31(29,30)14-4-1-3-12(7-14)9-23/h1-8,10-11H,(H,26,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	4.80E+4	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310090 (US10377768, Compound 4 | US9657033, Compound 4) Show SMILES Fc1ccc(cc1)S(=O)(=O)n1ncc2cnc(NC(=O)c3c(F)cccc3F)cc12 Show InChI InChI=1S/C19H11F3N4O3S/c20-12-4-6-13(7-5-12)30(28,29)26-16-8-17(23-9-11(16)10-24-26)25-19(27)18-14(21)2-1-3-15(18)22/h1-10H,(H,23,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310091 (US10377768, Compound 5 | US9657033, Compound 5) Show SMILES Fc1ccc(cc1)S(=O)(=O)n1ncc2cnc(NC(=O)c3c(Cl)cccc3Cl)cc12 Show InChI InChI=1S/C19H11Cl2FN4O3S/c20-14-2-1-3-15(21)18(14)19(27)25-17-8-16-11(9-23-17)10-24-26(16)30(28,29)13-6-4-12(22)5-7-13/h1-10H,(H,23,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	2.61E+3	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310092 (US9657033, Compound 6) Show SMILES Fc1ccc(cc1)S(=O)(=O)n1ncc2cnc(NC(=O)c3c(Cl)cccc3C(F)(F)F)cc12 Show InChI InChI=1S/C20H11ClF4N4O3S/c21-15-3-1-2-14(20(23,24)25)18(15)19(30)28-17-8-16-11(9-26-17)10-27-29(16)33(31,32)13-6-4-12(22)5-7-13/h1-10H,(H,26,28,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	2.41E+3	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310093 (US10377768, Compound 7 | US9657033, Compound 7) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1cc2n(ncc2cn1)S(=O)(=O)c1cccc(Cl)c1 Show InChI InChI=1S/C19H11Cl2FN4O3S/c20-12-3-1-4-13(7-12)30(28,29)26-16-8-17(23-9-11(16)10-24-26)25-19(27)18-14(21)5-2-6-15(18)22/h1-10H,(H,23,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	6.44E+3	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310094 (US10377768, Compound 8 | US9657033, Compound 8) Show SMILES FC(F)Oc1cccc(c1)S(=O)(=O)n1ncc2cnc(NC(=O)c3c(F)cccc3Cl)cc12 Show InChI InChI=1S/C20H12ClF3N4O4S/c21-14-5-2-6-15(22)18(14)19(29)27-17-8-16-11(9-25-17)10-26-28(16)33(30,31)13-4-1-3-12(7-13)32-20(23)24/h1-10,20H,(H,25,27,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.06E+3	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310095 (US10377768, Compound 9 | US9657033, Compound 9) Show SMILES CC(C)(C)c1cccc(c1)S(=O)(=O)n1ncc2cnc(NC(=O)c3c(F)cccc3Cl)cc12 Show InChI InChI=1S/C23H20ClFN4O3S/c1-23(2,3)15-6-4-7-16(10-15)33(31,32)29-19-11-20(26-12-14(19)13-27-29)28-22(30)21-17(24)8-5-9-18(21)25/h4-13H,1-3H3,(H,26,28,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	3.52E+3	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310096 (US10377768, Compound 10 | US9657033, Compound 10) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1cc2n(ncc2cn1)S(=O)(=O)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C20H11ClF4N4O3S/c21-14-5-2-6-15(22)18(14)19(30)28-17-8-16-11(9-26-17)10-27-29(16)33(31,32)13-4-1-3-12(7-13)20(23,24)25/h1-10H,(H,26,28,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	3.63E+3	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310097 (US10377768, Compound 11 | US9657033, Compound 11) Show SMILES Cc1nn(cc1S(=O)(=O)n1ncc2cnc(NC(=O)c3c(F)cccc3Cl)cc12)C(F)F Show InChI InChI=1S/C18H12ClF3N6O3S/c1-9-14(8-27(26-9)18(21)22)32(30,31)28-13-5-15(23-6-10(13)7-24-28)25-17(29)16-11(19)3-2-4-12(16)20/h2-8,18H,1H3,(H,23,25,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	447	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310098 (2-chloro-6-fluoro-N-[1-(4-fluorobenzenesulfonyl)-2...) Show SMILES CC1COc2ncc(NC(=O)c3c(F)cccc3Cl)cc2N1S(=O)(=O)c1ccc(F)cc1 Show InChI InChI=1S/C21H16ClF2N3O4S/c1-12-11-31-21-18(27(12)32(29,30)15-7-5-13(23)6-8-15)9-14(10-25-21)26-20(28)19-16(22)3-2-4-17(19)24/h2-10,12H,11H2,1H3,(H,26,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	250	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310099 (2-chloro-6-fluoro-N-[1-(4-fluorobenzenesulfonyl)-2...) Show SMILES Fc1ccc(cc1)S(=O)(=O)N1CCOc2ncc(NC(=O)c3c(F)cccc3Cl)cc12 Show InChI InChI=1S/C20H14ClF2N3O4S/c21-15-2-1-3-16(23)18(15)19(27)25-13-10-17-20(24-11-13)30-9-8-26(17)31(28,29)14-6-4-12(22)5-7-14/h1-7,10-11H,8-9H2,(H,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	174	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310100 ((S)-2-chloro-6-fluoro-N-(3-methyl-1-(m-tolylsulfon...) Show SMILES C[C@H]1CN(c2cc(NC(=O)c3c(F)cccc3Cl)cnc2O1)S(=O)(=O)c1cccc(C)c1 |r| Show InChI InChI=1S/C22H19ClFN3O4S/c1-13-5-3-6-16(9-13)32(29,30)27-12-14(2)31-22-19(27)10-15(11-25-22)26-21(28)20-17(23)7-4-8-18(20)24/h3-11,14H,12H2,1-2H3,(H,26,28)/t14-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	166	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310101 ((S)-2-chloro-N-(1-((3-ethylphenyl)sulfonyl)-3-meth...) Show SMILES CCc1cccc(c1)S(=O)(=O)N1C[C@H](C)Oc2ncc(NC(=O)c3c(F)cccc3Cl)cc12 |r| Show InChI InChI=1S/C23H21ClFN3O4S/c1-3-15-6-4-7-17(10-15)33(30,31)28-13-14(2)32-23-20(28)11-16(12-26-23)27-22(29)21-18(24)8-5-9-19(21)25/h4-12,14H,3,13H2,1-2H3,(H,27,29)/t14-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	31	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310102 ((S)-N-(3-(acetamidomethyl)-1-(m-tolylsulfonyl)-2,3...) Show SMILES CC(=O)NC[C@H]1CN(c2cc(NC(=O)c3c(F)cccc3Cl)cnc2O1)S(=O)(=O)c1cccc(C)c1 |r| Show InChI InChI=1S/C24H22ClFN4O5S/c1-14-5-3-6-18(9-14)36(33,34)30-13-17(12-27-15(2)31)35-24-21(30)10-16(11-28-24)29-23(32)22-19(25)7-4-8-20(22)26/h3-11,17H,12-13H2,1-2H3,(H,27,31)(H,29,32)/t17-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	336	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310103 ((S)-N-((S)-3-(Acetamidomethyl)-1-(m-tolylsulfonyl)...) Show SMILES C[C@H](C(=O)Nc1cnc2O[C@@H](CNC(C)=O)CN(c2c1)S(=O)(=O)c1cccc(C)c1)c1ccccc1 |r| Show InChI InChI=1S/C26H28N4O5S/c1-17-8-7-11-23(12-17)36(33,34)30-16-22(15-27-19(3)31)35-26-24(30)13-21(14-28-26)29-25(32)18(2)20-9-5-4-6-10-20/h4-14,18,22H,15-16H2,1-3H3,(H,27,31)(H,29,32)/t18-,22-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	760	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310105 (US10377768, Compound 19 | US9657033, Compound 19) Show SMILES CC1COc2ncc(NC(=O)c3c(Cl)cccc3C(F)(F)F)cc2N1S(=O)(=O)c1ccc(F)cc1 Show InChI InChI=1S/C22H16ClF4N3O4S/c1-12-11-34-21-18(30(12)35(32,33)15-7-5-13(24)6-8-15)9-14(10-28-21)29-20(31)19-16(22(25,26)27)3-2-4-17(19)23/h2-10,12H,11H2,1H3,(H,29,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	20	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310106 (US10377768, Compound 20 | US9657033, Compound 20) Show SMILES CC1COc2ncc(NC(=O)c3c(F)cccc3Cl)cc2N1S(=O)(=O)c1cccc(c1)C#N Show InChI InChI=1S/C22H16ClFN4O4S/c1-13-12-32-22-19(28(13)33(30,31)16-5-2-4-14(8-16)10-25)9-15(11-26-22)27-21(29)20-17(23)6-3-7-18(20)24/h2-9,11,13H,12H2,1H3,(H,27,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	390	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310107 (US10377768, Compound 21 | US9657033, Compound 21) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1cnc2OCCN(c2c1)S(=O)(=O)c1cccc(c1)C#N Show InChI InChI=1S/C21H14ClFN4O4S/c22-16-5-2-6-17(23)19(16)20(28)26-14-10-18-21(25-12-14)31-8-7-27(18)32(29,30)15-4-1-3-13(9-15)11-24/h1-6,9-10,12H,7-8H2,(H,26,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310108 (US10377768, Compound 22 | US9657033, Compound 22) Show SMILES Fc1cccc(Cl)c1C(=O)Nc1cnc2OCCN(c2c1)S(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C20H14Cl2FN3O4S/c21-12-4-6-14(7-5-12)31(28,29)26-8-9-30-20-17(26)10-13(11-24-20)25-19(27)18-15(22)2-1-3-16(18)23/h1-7,10-11H,8-9H2,(H,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	90	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310109 (US10377768, Compound 23 | US9657033, Compound 23) Show SMILES Fc1ccc(cc1F)S(=O)(=O)N1CCOc2ncc(NC(=O)c3c(F)cccc3Cl)cc12 Show InChI InChI=1S/C20H13ClF3N3O4S/c21-13-2-1-3-15(23)18(13)19(28)26-11-8-17-20(25-10-11)31-7-6-27(17)32(29,30)12-4-5-14(22)16(24)9-12/h1-5,8-10H,6-7H2,(H,26,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	100	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310110 (US10377768, Compound 24 | US9657033, Compound 24) Show SMILES C[C@H]1CN(c2cc(NC(=O)c3c(F)cccc3C(F)(F)F)cnc2O1)S(=O)(=O)c1cccc(C)c1 |r| Show InChI InChI=1S/C23H19F4N3O4S/c1-13-5-3-6-16(9-13)35(32,33)30-12-14(2)34-22-19(30)10-15(11-28-22)29-21(31)20-17(23(25,26)27)7-4-8-18(20)24/h3-11,14H,12H2,1-2H3,(H,29,31)/t14-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	132	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310111 (US10377768, Compound 25 | US9657033, Compound 25) Show SMILES C[C@H]1CN(c2cc(NC(=O)c3c(F)cccc3Cl)cnc2O1)S(=O)(=O)c1cccc(c1)C#N |r| Show InChI InChI=1S/C22H16ClFN4O4S/c1-13-12-28(33(30,31)16-5-2-4-14(8-16)10-25)19-9-15(11-26-22(19)32-13)27-21(29)20-17(23)6-3-7-18(20)24/h2-9,11,13H,12H2,1H3,(H,27,29)/t13-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.03E+3	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310112 (US10377768, Compound 26 | US9657033, Compound 26) Show SMILES C[C@H]1CN(c2cc(NC(=O)c3c(F)cccc3Cl)cnc2O1)S(=O)(=O)c1ccc(F)cc1 |r| Show InChI InChI=1S/C21H16ClF2N3O4S/c1-12-11-27(32(29,30)15-7-5-13(23)6-8-15)18-9-14(10-25-21(18)31-12)26-20(28)19-16(22)3-2-4-17(19)24/h2-10,12H,11H2,1H3,(H,26,28)/t12-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	829	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310113 (US10377768, Compound 27 | US9657033, Compound 27) Show SMILES C[C@H]1CN(c2cc(NC(=O)c3c(F)cccc3Cl)cnc2O1)S(=O)(=O)c1cccc(c1)C1CC1 |r| Show InChI InChI=1S/C24H21ClFN3O4S/c1-14-13-29(34(31,32)18-5-2-4-16(10-18)15-8-9-15)21-11-17(12-27-24(21)33-14)28-23(30)22-19(25)6-3-7-20(22)26/h2-7,10-12,14-15H,8-9,13H2,1H3,(H,28,30)/t14-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	20	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310114 (US10377768, Compound 28 | US9657033, Compound 28) Show SMILES C[C@H](C(=O)Nc1cnc2O[C@@H](C)CN(c2c1)S(=O)(=O)c1cccc(C)c1)c1ccccc1 |r| Show InChI InChI=1S/C24H25N3O4S/c1-16-8-7-11-21(12-16)32(29,30)27-15-17(2)31-24-22(27)13-20(14-25-24)26-23(28)18(3)19-9-5-4-6-10-19/h4-14,17-18H,15H2,1-3H3,(H,26,28)/t17-,18-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	810	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310115 (US10377768, Compound 29 | US9657033, Compound 29) Show SMILES C[C@H](C(=O)Nc1cnc2O[C@@H](C)CN(c2c1)S(=O)(=O)c1ccc(F)cc1)c1ccccc1 |r| Show InChI InChI=1S/C23H22FN3O4S/c1-15-14-27(32(29,30)20-10-8-18(24)9-11-20)21-12-19(13-25-23(21)31-15)26-22(28)16(2)17-6-4-3-5-7-17/h3-13,15-16H,14H2,1-2H3,(H,26,28)/t15-,16-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	3.05E+3	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310122 (2,6-difluoro-N-(5-(4-fluorobenzenesulfonyl)-5,6,7,...) Show SMILES Fc1ccc(cc1)S(=O)(=O)N1CCCc2ncc(NC(=O)c3c(F)cccc3F)cc12 Show InChI InChI=1S/C21H16F3N3O3S/c22-13-6-8-15(9-7-13)31(29,30)27-10-2-5-18-19(27)11-14(12-25-18)26-21(28)20-16(23)3-1-4-17(20)24/h1,3-4,6-9,11-12H,2,5,10H2,(H,26,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	700	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310123 (2-chloro-6-fluoro-N-(5-(m-tolylsulfonyl)-5,6,7,8-t...) Show SMILES Cc1cccc(c1)S(=O)(=O)N1CCCc2ncc(NC(=O)c3c(F)cccc3Cl)cc12 Show InChI InChI=1S/C22H19ClFN3O3S/c1-14-5-2-6-16(11-14)31(29,30)27-10-4-9-19-20(27)12-15(13-25-19)26-22(28)21-17(23)7-3-8-18(21)24/h2-3,5-8,11-13H,4,9-10H2,1H3,(H,26,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	52	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM310088 (2-chloro-6-fluoro-N-[1-(4-fluorobenzenesulfonyl)-1...) Show SMILES Fc1ccc(cc1)S(=O)(=O)n1ncc2cnc(NC(=O)c3c(F)cccc3Cl)cc12 Show InChI InChI=1S/C19H11ClF2N4O3S/c20-14-2-1-3-15(22)18(14)19(27)25-17-8-16-11(9-23-17)10-24-26(16)30(28,29)13-6-4-12(21)5-7-13/h1-10H,(H,23,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a
Lycera Corporation; Merck Sharp & Dohme Corp. US Patent					Assay Description Recombinant,HIS-tagged RORγ-LBD was expressed in SF9 cells using a baculovirus expression system. Cells were lysed and the lysate was used as a ...				US Patent US9657033 (2017) BindingDB Entry DOI: 10.7270/Q24Q7X2T
					More data for this Ligand-Target Pair