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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 102176   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Orexin receptor type 2


(Homo sapiens (Human))
BDBM102176
PNG
(US8530648, 102)
Show SMILES O=C1N(Cc2cccc(c2)-n2ccnn2)CCCC11CCN(CC1)c1cnc2ccccc2n1
Show InChI InChI=1S/C26H27N7O/c34-25-26(10-14-31(15-11-26)24-18-27-22-7-1-2-8-23(22)29-24)9-4-13-32(25)19-20-5-3-6-21(17-20)33-16-12-28-30-33/h1-3,5-8,12,16-18H,4,9-11,13-15,19H2
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PC cid
PC sid
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Similars

US Patent
247n/an/an/an/an/an/a7.4n/a



Novartis AG

US Patent


Assay Description
FLIPR assay using orexin receptor.


US Patent US8530648 (2013)


BindingDB Entry DOI: 10.7270/Q2SB44DR
More data for this
Ligand-Target Pair
Orexin/Hypocretin receptor type 1


(Homo sapiens (Human))
BDBM102176
PNG
(US8530648, 102)
Show SMILES O=C1N(Cc2cccc(c2)-n2ccnn2)CCCC11CCN(CC1)c1cnc2ccccc2n1
Show InChI InChI=1S/C26H27N7O/c34-25-26(10-14-31(15-11-26)24-18-27-22-7-1-2-8-23(22)29-24)9-4-13-32(25)19-20-5-3-6-21(17-20)33-16-12-28-30-33/h1-3,5-8,12,16-18H,4,9-11,13-15,19H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
1.10E+3n/an/an/an/an/an/a7.4n/a



Novartis AG

US Patent


Assay Description
FLIPR assay using orexin receptor.


US Patent US8530648 (2013)


BindingDB Entry DOI: 10.7270/Q2SB44DR
More data for this
Ligand-Target Pair