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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM203202'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Orexin receptor type 2


(Homo sapiens (Human))
BDBM203202
PNG
(US9242970, 384)
Show SMILES CCOc1cccc(F)c1C1CC(C)C(=O)N1Cc1cccc(c1)-c1ncc(C)s1
Show InChI InChI=1S/C24H25FN2O2S/c1-4-29-21-10-6-9-19(25)22(21)20-11-15(2)24(28)27(20)14-17-7-5-8-18(12-17)23-26-13-16(3)30-23/h5-10,12-13,15,20H,4,11,14H2,1-3H3
PDB

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US Patent
n/an/a 2n/an/an/an/an/a37



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
In Vitro Assay: Intracellular Calcium Measurements:Chinese hamster ovary (CHO) cells expressing the human orexin-1 receptor and the human orexin-2 re...


US Patent US9242970 (2016)


BindingDB Entry DOI: 10.7270/Q2R49PK4
More data for this
Ligand-Target Pair