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SMILES: C[C@@H]1C[C@H](NS(C)(=O)=O)[C@@H]2CO[C@H]3CC[C@H](CC3)c3cc(F)cc(OCCCOC(=O)N12)c3

InChI Key:

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 559697   
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))		BDBM559697
PNG
(WO2022109117, Example 42)
Show SMILES C[C@@H]1C[C@H](NS(C)(=O)=O)[C@@H]2CO[C@H]3CC[C@H](CC3)c3cc(F)cc(OCCCOC(=O)N12)c3 |wU:1.0,3.3,12.12,15.14,9.33,(18.09,4.06,;16.93,5.05,;17.05,6.57,;15.65,7.15,;15.3,8.63,;16.4,9.68,;17.51,10.72,;17.45,8.57,;15.36,10.78,;14.66,6,;13.41,6.95,;11.87,7.31,;10.39,6.79,;10.91,5.34,;9.96,4.16,;8.42,4.3,;7.9,5.78,;8.84,7,;7.92,2.75,;6.52,2.04,;6.35,.52,;4.96,-.1,;7.6,-.36,;9.03,.24,;10.34,-.63,;11.85,-.95,;13.35,-.6,;14.61,.29,;15.46,1.59,;15.76,3.12,;17.29,3.12,;15.45,4.7,;9.13,1.78,)|
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
WIPO WO2022109117
n/an/a 0.170n/an/an/an/an/an/a


TBA

Assay Description
In a typical experiment, the OXI and OX2 receptor agonist activity is determined in accordance with the following general experimental method. Chines...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2C53Q2G
More data for this
Ligand-Target Pair