BDBM143783 US10183953, Example 44::US8969352, 44::US9611277, Example 44::US9845333, 44

SMILES: Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1

InChI Key: InChIKey=NOXUACCAWHVGCM-UHFFFAOYSA-N

Data: 18 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 18 hits for monomerid = 143783   

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 receptor type 1 (OX1) (Rattus norvegicus (Rat))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	21	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 US10183953 (2019) BindingDB Entry DOI: 10.7270/Q2Z60R5Q
					More data for this Ligand-Target Pair
Orexin receptor type 1 (OX1) (Rattus norvegicus (Rat))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	21	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 US9611277 (2017) BindingDB Entry DOI: 10.7270/Q24B33D2
					More data for this Ligand-Target Pair
Orexin receptor type 1 (OX1) (Rattus norvegicus (Rat))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	22	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 US10183953 (2019) BindingDB Entry DOI: 10.7270/Q2Z60R5Q
					More data for this Ligand-Target Pair
Orexin receptor type 1 (OX1) (Rattus norvegicus (Rat))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA US Patent					Assay Description Rat and Human Orexin 1 Receptor:Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_00152...				US Patent US9845333 (2017) BindingDB Entry DOI: 10.7270/Q21838TW
					More data for this Ligand-Target Pair
Orexin receptor type 1 (OX1) (Rattus norvegicus (Rat))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	22	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 US9611277 (2017) BindingDB Entry DOI: 10.7270/Q24B33D2
					More data for this Ligand-Target Pair
Orexin receptor type 1 (OX1) (Rattus norvegicus (Rat))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	22	-9.70	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 US8969352 (2015) BindingDB Entry DOI: 10.7270/Q2FB51PC
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	39	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description CHO cells stably transfected with the human orexin 1 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM/F12, 10% FBS, 1×...				US Patent US10183953 (2019) BindingDB Entry DOI: 10.7270/Q2Z60R5Q
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	39	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 US9611277 (2017) BindingDB Entry DOI: 10.7270/Q24B33D2
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	42	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 US9611277 (2017) BindingDB Entry DOI: 10.7270/Q24B33D2
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	42	-9.35	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 US8969352 (2015) BindingDB Entry DOI: 10.7270/Q2FB51PC
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA US Patent					Assay Description Rat and Human Orexin 1 Receptor:Human Embryonic Kidney 293 cells (HEK293) stably expressing rat orexin 1 receptor (Genebank accession number NM_00152...				US Patent US9845333 (2017) BindingDB Entry DOI: 10.7270/Q21838TW
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description CHO cells stably transfected with the human orexin 1 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM/F12, 10% FBS, 1×...				US Patent US10183953 (2019) BindingDB Entry DOI: 10.7270/Q2Z60R5Q
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.20E+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 US9611277 (2017) BindingDB Entry DOI: 10.7270/Q24B33D2
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.20E+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 US8969352 (2015) BindingDB Entry DOI: 10.7270/Q2FB51PC
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description PFSK-1 cells endogenously expressing the human orexin 2 receptor were grown to confluency in RPMI1640 (Hyclone, cat #30027.02), 10% FBS, 1× pen-strep...				US Patent US10183953 (2019) BindingDB Entry DOI: 10.7270/Q2Z60R5Q
					More data for this Ligand-Target Pair
Orexin receptor type 2 (OX2) (Rattus norvegicus (Rat))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA US Patent					Assay Description Human Orexin 2 Receptor:HEK293 stably expressing human orexin 2 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM (Hycl...				US Patent US9845333 (2017) BindingDB Entry DOI: 10.7270/Q21838TW
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.33E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description PFSK-1 cells endogenously expressing the human orexin 2 receptor were grown to confluency in RPMI1640 (Hyclone, cat #30027.02), 10% FBS, 1× pen-strep...				US Patent US10183953 (2019) BindingDB Entry DOI: 10.7270/Q2Z60R5Q
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM143783 (US10183953, Example 44 | US8969352, 44 | US9611277...) Show SMILES Fc1ccc(C(=O)N2CC3CC(Oc4ccc(cn4)C(F)(F)F)C2C3)c(c1)-n1nccn1 |TLB:12:11:7.8:24,5:7:11.10:24| Show InChI InChI=1S/C21H17F4N5O2/c22-14-2-3-15(16(9-14)30-27-5-6-28-30)20(31)29-11-12-7-17(29)18(8-12)32-19-4-1-13(10-26-19)21(23,24)25/h1-6,9-10,12,17-18H,7-8,11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.33E+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 US9611277 (2017) BindingDB Entry DOI: 10.7270/Q24B33D2
					More data for this Ligand-Target Pair