Compile Data Set for Download or QSAR

Found 14 hits of ki for monomerid = 164094   

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
Orexin/Hypocretin receptor type 1 (Rattus norvegicus (Rat))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.50E+3	-7.10	n/a	n/a	n/a	n/a	n/a	n/a	4
JANSSEN PHARMACEUTICA NV US Patent					Assay Description Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_001525) or Chinese ovary cells (CHO) ...				US Patent US9695183 (2017) BindingDB Entry DOI: 10.7270/Q2N58JHM
					More data for this Ligand-Target Pair
Orexin/Hypocretin receptor type 1 (Rattus norvegicus (Rat))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_001525) or Chinese ovary cells (CHO) ...				US Patent US9637496 (2017) BindingDB Entry DOI: 10.7270/Q24J0H68
					More data for this Ligand-Target Pair
Orexin/Hypocretin receptor type 1 (Rattus norvegicus (Rat))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.50E+3	-7.10	n/a	n/a	n/a	n/a	n/a	n/a	4
Janssen Pharmaceutica NV US Patent					Assay Description Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_001525) or Chinese ovary cells (CHO) ...				US Patent US9475819 (2016) BindingDB Entry DOI: 10.7270/Q2DZ0771
					More data for this Ligand-Target Pair
Orexin/Hypocretin receptor type 1 (Rattus norvegicus (Rat))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.50E+3	-8.02	n/a	n/a	n/a	n/a	n/a	n/a	40
JANSSEN PHARMACEUTICA NV US Patent					Assay Description HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM001526) were grown to confluency in DMEM (Hyclone, cat #SH30022), 10% F...				US Patent US9062078 (2015) BindingDB Entry DOI: 10.7270/Q2RX99V3
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	7.40E+3	-7.35	n/a	n/a	n/a	n/a	n/a	n/a	40
JANSSEN PHARMACEUTICA NV US Patent					Assay Description HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM001526) were grown to confluency in DMEM (Hyclone, cat #SH30022), 10% F...				US Patent US9062078 (2015) BindingDB Entry DOI: 10.7270/Q2RX99V3
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	7.40E+3	-7.35	n/a	n/a	n/a	n/a	n/a	n/a	40
Janssen Pharmaceutica NV US Patent					Assay Description HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hyclone, cat #SH30022), 10% ...				US Patent US9475819 (2016) BindingDB Entry DOI: 10.7270/Q2DZ0771
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	7.40E+3	-7.35	n/a	n/a	n/a	n/a	n/a	n/a	40
JANSSEN PHARMACEUTICA NV US Patent					Assay Description HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hyclone, cat # SH30022), 10%...				US Patent US9695183 (2017) BindingDB Entry DOI: 10.7270/Q2N58JHM
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	7.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hyclone, cat #SH30022), 10% ...				US Patent US9637496 (2017) BindingDB Entry DOI: 10.7270/Q24J0H68
					More data for this Ligand-Target Pair
Orexin/Hypocretin receptor type 1 (Rattus norvegicus (Rat))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_001525) or Chinese ovary cells (CHO) ...				US Patent US9637496 (2017) BindingDB Entry DOI: 10.7270/Q24J0H68
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	>1.00E+4	>-7.16	n/a	n/a	n/a	n/a	n/a	n/a	40
Janssen Pharmaceutica NV US Patent					Assay Description HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hyclone, cat #SH30022), 10% ...				US Patent US9475819 (2016) BindingDB Entry DOI: 10.7270/Q2DZ0771
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	>1.00E+4	>-7.16	n/a	n/a	n/a	n/a	n/a	n/a	40
JANSSEN PHARMACEUTICA NV US Patent					Assay Description HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hyclone, cat # SH30022), 10%...				US Patent US9695183 (2017) BindingDB Entry DOI: 10.7270/Q2N58JHM
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hyclone, cat #SH30022), 10% ...				US Patent US9637496 (2017) BindingDB Entry DOI: 10.7270/Q24J0H68
					More data for this Ligand-Target Pair
Orexin/Hypocretin receptor type 1 (Rattus norvegicus (Rat))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	>1.00E+4	>-6.34	n/a	n/a	n/a	n/a	n/a	n/a	4
Janssen Pharmaceutica NV US Patent					Assay Description Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_001525) or Chinese ovary cells (CHO) ...				US Patent US9475819 (2016) BindingDB Entry DOI: 10.7270/Q2DZ0771
					More data for this Ligand-Target Pair
Orexin/Hypocretin receptor type 1 (Rattus norvegicus (Rat))	BDBM164094 (US9062078, 224 | US9475819, 227 | US9637496, 227 |...) Show SMILES CCOc1ccc(C)nc1C(=O)N1C2CCC1C(C2)Nc1ncc(cn1)C(F)(F)F |TLB:19:17:15.14:12| Show InChI InChI=1S/C20H22F3N5O2/c1-3-30-16-7-4-11(2)26-17(16)18(29)28-13-5-6-15(28)14(8-13)27-19-24-9-12(10-25-19)20(21,22)23/h4,7,9-10,13-15H,3,5-6,8H2,1-2H3,(H,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	>1.00E+4	>-6.34	n/a	n/a	n/a	n/a	n/a	n/a	4
JANSSEN PHARMACEUTICA NV US Patent					Assay Description Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_001525) or Chinese ovary cells (CHO) ...				US Patent US9695183 (2017) BindingDB Entry DOI: 10.7270/Q2N58JHM
					More data for this Ligand-Target Pair