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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 102153   
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))
BDBM102153
PNG
(US8530648, 50)
Show SMILES FC(F)(F)c1ccccc1CN1CCCC2(CCN(CC2)c2cnc3ccccc3n2)C1=O
Show InChI InChI=1S/C25H25F3N4O/c26-25(27,28)19-7-2-1-6-18(19)17-32-13-5-10-24(23(32)33)11-14-31(15-12-24)22-16-29-20-8-3-4-9-21(20)30-22/h1-4,6-9,16H,5,10-15,17H2
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PC cid
PC sid
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Similars

US Patent
280n/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))
BDBM102153
PNG
(US8530648, 50)
Show SMILES FC(F)(F)c1ccccc1CN1CCCC2(CCN(CC2)c2cnc3ccccc3n2)C1=O
Show InChI InChI=1S/C25H25F3N4O/c26-25(27,28)19-7-2-1-6-18(19)17-32-13-5-10-24(23(32)33)11-14-31(15-12-24)22-16-29-20-8-3-4-9-21(20)30-22/h1-4,6-9,16H,5,10-15,17H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
2.74E+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