BDBM257692 US9493446, 161

SMILES: Fc1cc(C(=O)N2CCC[C@H]2c2nc(no2)-c2ccccc2OC(F)(F)F)c(cc1F)-n1nccn1

InChI Key: InChIKey=ZHOGJEPPCJWXMP-INIZCTEOSA-N

Data: 2 IC50

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 2 hits for monomerid = 257692   

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))	BDBM257692 (US9493446, 161) Show SMILES Fc1cc(C(=O)N2CCC[C@H]2c2nc(no2)-c2ccccc2OC(F)(F)F)c(cc1F)-n1nccn1 Show InChI InChI=1S/C22H15F5N6O3/c23-14-10-13(17(11-15(14)24)33-28-7-8-29-33)21(34)32-9-3-5-16(32)20-30-19(31-36-20)12-4-1-2-6-18(12)35-22(25,26)27/h1-2,4,6-8,10-11,16H,3,5,9H2/t16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar	PC cid PC sid UniChem	US Patent	n/a	n/a	204	n/a	n/a	n/a	n/a	n/a	37
Actelion Pharmaceuticals Ltd US Patent					Assay Description Human orexin-A as an agonist is prepared as 1 mM stock solution in MeOH: water (1:1), diluted in HBSS containing 0.1% bovine serum albumin (BSA), NaH...				US Patent US9493446 (2016) BindingDB Entry DOI: 10.7270/Q2DR2TD0
					More data for this Ligand-Target Pair
Orexin receptor type 1 (Homo sapiens (Human))	BDBM257692 (US9493446, 161) Show SMILES Fc1cc(C(=O)N2CCC[C@H]2c2nc(no2)-c2ccccc2OC(F)(F)F)c(cc1F)-n1nccn1 Show InChI InChI=1S/C22H15F5N6O3/c23-14-10-13(17(11-15(14)24)33-28-7-8-29-33)21(34)32-9-3-5-16(32)20-30-19(31-36-20)12-4-1-2-6-18(12)35-22(25,26)27/h1-2,4,6-8,10-11,16H,3,5,9H2/t16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar	PC cid PC sid UniChem	US Patent	n/a	n/a	751	n/a	n/a	n/a	n/a	n/a	37
Actelion Pharmaceuticals Ltd US Patent					Assay Description Human orexin-A as an agonist is prepared as 1 mM stock solution in MeOH: water (1:1), diluted in HBSS containing 0.1% bovine serum albumin (BSA), NaH...				US Patent US9493446 (2016) BindingDB Entry DOI: 10.7270/Q2DR2TD0
					More data for this Ligand-Target Pair