BDBM118666 US8653263, 319::US9586962, Example 319

SMILES: Cc1noc(n1)-c1ccccc1C(=O)N1CC2CN(CC2C1)c1nc2CCCc2c(C)n1

InChI Key: InChIKey=KWUIJSNANKEMLK-UHFFFAOYSA-N

Data: 4 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 8 hits for monomerid = 118666   

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 2 (Homo sapiens (Human))	BDBM118666 (US11059828, Example 319 | US8653263, 319 | US95869...) Show SMILES Cc1noc(n1)-c1ccccc1C(=O)N1CC2CN(CC2C1)c1nc2CCCc2c(C)n1 Show InChI InChI=1S/C24H26N6O2/c1-14-18-8-5-9-21(18)27-24(25-14)30-12-16-10-29(11-17(16)13-30)23(31)20-7-4-3-6-19(20)22-26-15(2)28-32-22/h3-4,6-7,16-17H,5,8-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM118666 (US11059828, Example 319 | US8653263, 319 | US95869...) Show SMILES Cc1noc(n1)-c1ccccc1C(=O)N1CC2CN(CC2C1)c1nc2CCCc2c(C)n1 Show InChI InChI=1S/C24H26N6O2/c1-14-18-8-5-9-21(18)27-24(25-14)30-12-16-10-29(11-17(16)13-30)23(31)20-7-4-3-6-19(20)22-26-15(2)28-32-22/h3-4,6-7,16-17H,5,8-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	18	-10.6	n/a	n/a	n/a	n/a	n/a	n/a	25
Janssen Pharmaceutica NV US Patent					Assay Description Chinese ovary cells (CHO) stably expressing human orexin 1 receptor (Genebank accession number NM_001526) were grown to confluency in DMEM/F12 (Gibco...				US Patent US9586962 (2017) BindingDB Entry DOI: 10.7270/Q27H1MN9
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM118666 (US11059828, Example 319 | US8653263, 319 | US95869...) Show SMILES Cc1noc(n1)-c1ccccc1C(=O)N1CC2CN(CC2C1)c1nc2CCCc2c(C)n1 Show InChI InChI=1S/C24H26N6O2/c1-14-18-8-5-9-21(18)27-24(25-14)30-12-16-10-29(11-17(16)13-30)23(31)20-7-4-3-6-19(20)22-26-15(2)28-32-22/h3-4,6-7,16-17H,5,8-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM118666 (US11059828, Example 319 | US8653263, 319 | US95869...) Show SMILES Cc1noc(n1)-c1ccccc1C(=O)N1CC2CN(CC2C1)c1nc2CCCc2c(C)n1 Show InChI InChI=1S/C24H26N6O2/c1-14-18-8-5-9-21(18)27-24(25-14)30-12-16-10-29(11-17(16)13-30)23(31)20-7-4-3-6-19(20)22-26-15(2)28-32-22/h3-4,6-7,16-17H,5,8-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica US Patent					Assay Description The in vitro affinity of the compounds for the human orexin-1 and orexin-2 receptors was determined by competitive radioligand binding using [3H]SB S...				US Patent US8653263 (2014) BindingDB Entry DOI: 10.7270/Q2BR8QV7
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM118666 (US11059828, Example 319 | US8653263, 319 | US95869...) Show SMILES Cc1noc(n1)-c1ccccc1C(=O)N1CC2CN(CC2C1)c1nc2CCCc2c(C)n1 Show InChI InChI=1S/C24H26N6O2/c1-14-18-8-5-9-21(18)27-24(25-14)30-12-16-10-29(11-17(16)13-30)23(31)20-7-4-3-6-19(20)22-26-15(2)28-32-22/h3-4,6-7,16-17H,5,8-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		537	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM118666 (US11059828, Example 319 | US8653263, 319 | US95869...) Show SMILES Cc1noc(n1)-c1ccccc1C(=O)N1CC2CN(CC2C1)c1nc2CCCc2c(C)n1 Show InChI InChI=1S/C24H26N6O2/c1-14-18-8-5-9-21(18)27-24(25-14)30-12-16-10-29(11-17(16)13-30)23(31)20-7-4-3-6-19(20)22-26-15(2)28-32-22/h3-4,6-7,16-17H,5,8-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars		537	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM118666 (US11059828, Example 319 | US8653263, 319 | US95869...) Show SMILES Cc1noc(n1)-c1ccccc1C(=O)N1CC2CN(CC2C1)c1nc2CCCc2c(C)n1 Show InChI InChI=1S/C24H26N6O2/c1-14-18-8-5-9-21(18)27-24(25-14)30-12-16-10-29(11-17(16)13-30)23(31)20-7-4-3-6-19(20)22-26-15(2)28-32-22/h3-4,6-7,16-17H,5,8-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	537	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica US Patent					Assay Description The in vitro affinity of the compounds for the human orexin-1 and orexin-2 receptors was determined by competitive radioligand binding using [3H]SB S...				US Patent US8653263 (2014) BindingDB Entry DOI: 10.7270/Q2BR8QV7
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM118666 (US11059828, Example 319 | US8653263, 319 | US95869...) Show SMILES Cc1noc(n1)-c1ccccc1C(=O)N1CC2CN(CC2C1)c1nc2CCCc2c(C)n1 Show InChI InChI=1S/C24H26N6O2/c1-14-18-8-5-9-21(18)27-24(25-14)30-12-16-10-29(11-17(16)13-30)23(31)20-7-4-3-6-19(20)22-26-15(2)28-32-22/h3-4,6-7,16-17H,5,8-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	537	-8.55	n/a	n/a	n/a	n/a	n/a	n/a	25
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/F12 (Gibco, Cat #11039), in D...				US Patent US9586962 (2017) BindingDB Entry DOI: 10.7270/Q27H1MN9
					More data for this Ligand-Target Pair