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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 = 'BDBM119573'   
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))
BDBM119573
PNG
(US8680275, 130)
Show SMILES Fc1ccc(c(c1)C(=O)N1CC[C@H]2CN([C@H]2C1)c1cc(ccn1)C(F)(F)F)-n1nccn1 |r|
Show InChI InChI=1S/C21H18F4N6O/c22-15-1-2-17(31-27-6-7-28-31)16(10-15)20(32)29-8-4-13-11-30(18(13)12-29)19-9-14(3-5-26-19)21(23,24)25/h1-3,5-7,9-10,13,18H,4,8,11-12H2/t13-,18-/m0/s1
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Similars

US Patent
31 -39.8n/an/an/an/an/an/a4



Janssen Pharmaceutica NV

US Patent


Assay Description
HEK293 stably expressing human orexin-2 receptor (Genebank accession number NM 001526) were grown to confluency in DMEM/F12 (Gibco, Cat #11039), in D...


US Patent US8680275 (2014)


BindingDB Entry DOI: 10.7270/Q2WH2NPF
More data for this
Ligand-Target Pair