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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 = 'BDBM335326'   
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))
BDBM335326
PNG
(US9732075, Example 6.94 | rac-(2-Cyclopropyl-5-m-t...)
Show SMILES Cc1cccc(c1)-c1sc(nc1C(=O)N1CC(=C)CC1c1nc2c(C)cccc2[nH]1)C1CC1
Show InChI InChI=1S/C27H26N4OS/c1-15-6-4-8-19(12-15)24-23(30-26(33-24)18-10-11-18)27(32)31-14-16(2)13-21(31)25-28-20-9-5-7-17(3)22(20)29-25/h4-9,12,18,21H,2,10-11,13-14H2,1,3H3,(H,28,29)
PDB

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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