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BDBM221340 US9303023, 39

SMILES: COc1ccc2[nH]cc(CCn3cc(NC(=O)c4ncoc4-c4cccc(Cl)c4)cn3)c2c1

InChI Key: InChIKey=NOHXLLCGOBOPMK-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 221340   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Orexin receptor type 2


(Homo sapiens (Human))
BDBM221340
PNG
(US9303023, 39)
Show SMILES COc1ccc2[nH]cc(CCn3cc(NC(=O)c4ncoc4-c4cccc(Cl)c4)cn3)c2c1
Show InChI InChI=1S/C24H20ClN5O3/c1-32-19-5-6-21-20(10-19)16(11-26-21)7-8-30-13-18(12-28-30)29-24(31)22-23(33-14-27-22)15-3-2-4-17(25)9-15/h2-6,9-14,26H,7-8H2,1H3,(H,29,31)
PDB

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US Patent
n/an/a 2n/an/an/an/an/a37



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