BDBM221332 US9303023, 31

SMILES: COc1cc2ccn(CCn3cc(NC(=O)c4ncoc4-c4ccc(C)c(C)c4)cn3)c2cc1OC

InChI Key: InChIKey=JCHXBDRPXJLMQG-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 221332   

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))	BDBM221332 (US9303023, 31) Show SMILES COc1cc2ccn(CCn3cc(NC(=O)c4ncoc4-c4ccc(C)c(C)c4)cn3)c2cc1OC Show InChI InChI=1S/C27H27N5O4/c1-17-5-6-20(11-18(17)2)26-25(28-16-36-26)27(33)30-21-14-29-32(15-21)10-9-31-8-7-19-12-23(34-3)24(35-4)13-22(19)31/h5-8,11-16H,9-10H2,1-4H3,(H,30,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	37
ACTELION PHARMACEUTICALS LTD. US Patent					Assay Description Chinese hamster ovary (CHO) cells expressing the human orexin-1 receptor and the human orexin-2 receptor, respectively, are grown in culture medium (...				US Patent US9303023 (2016) BindingDB Entry DOI: 10.7270/Q2251H10
					More data for this Ligand-Target Pair