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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 = 'BDBM334588'   
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))
BDBM334588
PNG
(US9732075, Example 3.12 | [(2S,4R)-2-(6-Chloro-7-m...)
Show SMILES CO[C@@H]1C[C@H](N(C1)C(=O)c1cc(OC)ccc1-n1nccn1)c1nc2ccc(Cl)c(C)c2[nH]1
Show InChI InChI=1S/C23H23ClN6O3/c1-13-17(24)5-6-18-21(13)28-22(27-18)20-11-15(33-3)12-29(20)23(31)16-10-14(32-2)4-7-19(16)30-25-8-9-26-30/h4-10,15,20H,11-12H2,1-3H3,(H,27,28)/t15-,20+/m1/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