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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 = 'BDBM335275'   
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))
BDBM335275
PNG
(US9732075, Example 6.47 | [(S)-2-(4,5-Dimethyl-1H-...)
Show SMILES Cc1nc(C(=O)N2CC(=C)C[C@H]2c2nc3c(C)c(C)ccc3[nH]2)c(s1)-c1ccc(C)c(C)c1
Show InChI InChI=1S/C27H28N4OS/c1-14-11-22(26-29-21-10-8-16(3)18(5)23(21)30-26)31(13-14)27(32)24-25(33-19(6)28-24)20-9-7-15(2)17(4)12-20/h7-10,12,22H,1,11,13H2,2-6H3,(H,29,30)/t22-/m0/s1
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US Patent
n/an/a 1n/an/an/an/an/an/a



IDORSIA 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 US9732075 (2017)

More data for this
Ligand-Target Pair