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BDBM187175 US9670181, 54 6,7-dimethoxy-4-((6-methoxy-2-((2,2,2-trifluoroethyl)amino)quinolin-3-yl)methyl)-1-propylisoquinolin-3-ol

SMILES: CCCc1nc(O)c(Cc2cc3cc(OC)ccc3nc2NCC(F)(F)F)c2cc(OC)c(OC)cc12

InChI Key: InChIKey=USIMWRYQHAXOHD-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 187175   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM187175
PNG
(US9670181, 54 6,7-dimethoxy-4-((6-methoxy-2-((2,2,...)
Show SMILES CCCc1nc(O)c(Cc2cc3cc(OC)ccc3nc2NCC(F)(F)F)c2cc(OC)c(OC)cc12
Show InChI InChI=1S/C27H28F3N3O4/c1-5-6-22-19-13-24(37-4)23(36-3)12-18(19)20(26(34)33-22)11-16-9-15-10-17(35-2)7-8-21(15)32-25(16)31-14-27(28,29)30/h7-10,12-13H,5-6,11,14H2,1-4H3,(H,31,32)(H,33,34)
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PC cid
PC sid
UniChem
US Patent
n/an/a 23n/an/an/an/a7.425



Allergan Inc

US Patent


Assay Description
The PDE assay is based on the homogenous time-resolved fluorescence resonance energy transfer (TR-FRET) technology (LANCE® from Perkin Elmer). This c...


US Patent US9670181 (2017)


BindingDB Entry DOI: 10.7270/Q21Z42KJ
More data for this
Ligand-Target Pair