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Patent code US10376504

Compile Data Set for Download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
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
Phosphodiesterase


(Macaca mulatta (Rhesus macaque))
BDBM408656
PNG
(US10376504, Example 1-7)
Show SMILES O=c1[nH]c2ccccc2c(N2CC[C@H](C2)n2cccn2)c1C#N
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
7.5n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp

US Patent


Assay Description
Rhesus PDE9A2 was amplified from rhesus whole brain cDNA (Biochain Institute) essentially as described in Hutson, et al. Neuropharmacology (2011) 61(...


US Patent US10376504 (2019)


BindingDB Entry DOI: 10.7270/Q2XK8HX6
More data for this
Ligand-Target Pair
Phosphodiesterase


(Macaca mulatta (Rhesus macaque))
BDBM408657
PNG
(4-(azepan-1-yl)-2- oxo-1,2- dihydroquinoline-3- ca...)
Show SMILES O=c1[nH]c2ccccc2c(N2CCCCCC2)c1C#N
Show InChI InChI=1S/C16H17N3O/c17-11-13-15(19-9-5-1-2-6-10-19)12-7-3-4-8-14(12)18-16(13)20/h3-4,7-8H,1-2,5-6,9-10H2,(H,18,20)
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
18n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp

US Patent


Assay Description
Rhesus PDE9A2 was amplified from rhesus whole brain cDNA (Biochain Institute) essentially as described in Hutson, et al. Neuropharmacology (2011) 61(...


US Patent US10376504 (2019)


BindingDB Entry DOI: 10.7270/Q2XK8HX6
More data for this
Ligand-Target Pair
Phosphodiesterase


(Macaca mulatta (Rhesus macaque))
BDBM408660
PNG
(4-(4,4- dimethylpiperidin-1- yl)-2-oxo-1,2- dihydr...)
Show SMILES CC1(C)CCN(CC1)c1c(C#N)c(=O)[nH]c2ccccc12
Show InChI InChI=1S/C17H19N3O/c1-17(2)7-9-20(10-8-17)15-12-5-3-4-6-14(12)19-16(21)13(15)11-18/h3-6H,7-10H2,1-2H3,(H,19,21)
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
26.3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp

US Patent


Assay Description
Rhesus PDE9A2 was amplified from rhesus whole brain cDNA (Biochain Institute) essentially as described in Hutson, et al. Neuropharmacology (2011) 61(...


US Patent US10376504 (2019)


BindingDB Entry DOI: 10.7270/Q2XK8HX6
More data for this
Ligand-Target Pair
Phosphodiesterase


(Macaca mulatta (Rhesus macaque))
BDBM408662
PNG
(4-((2-(oxetan-3- yl)ethyl)amino)-2- oxo-1,2- dihyd...)
Show SMILES O=c1[nH]c2ccccc2c(NCCC2COC2)c1C#N
Show InChI InChI=1S/C15H15N3O2/c16-7-12-14(17-6-5-10-8-20-9-10)11-3-1-2-4-13(11)18-15(12)19/h1-4,10H,5-6,8-9H2,(H2,17,18,19)
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
71.1n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp

US Patent


Assay Description
Rhesus PDE9A2 was amplified from rhesus whole brain cDNA (Biochain Institute) essentially as described in Hutson, et al. Neuropharmacology (2011) 61(...


US Patent US10376504 (2019)


BindingDB Entry DOI: 10.7270/Q2XK8HX6
More data for this
Ligand-Target Pair
Phosphodiesterase


(Macaca mulatta (Rhesus macaque))
BDBM408659
PNG
(4-(diethylamino)-2- oxo-1,2- dihydroquinoline-3- c...)
Show SMILES CCN(CC)c1c(C#N)c(=O)[nH]c2ccccc12
Show InChI InChI=1S/C14H15N3O/c1-3-17(4-2)13-10-7-5-6-8-12(10)16-14(18)11(13)9-15/h5-8H,3-4H2,1-2H3,(H,16,18)
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
88.9n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp

US Patent


Assay Description
Rhesus PDE9A2 was amplified from rhesus whole brain cDNA (Biochain Institute) essentially as described in Hutson, et al. Neuropharmacology (2011) 61(...


US Patent US10376504 (2019)


BindingDB Entry DOI: 10.7270/Q2XK8HX6
More data for this
Ligand-Target Pair
Phosphodiesterase


(Macaca mulatta (Rhesus macaque))
BDBM408658
PNG
(4-(azetidin-1-yl)-2- oxo-1,2- dihydroquinoline-3- ...)
Show SMILES O=c1[nH]c2ccccc2c(N2CCC2)c1C#N
Show InChI InChI=1S/C13H11N3O/c14-8-10-12(16-6-3-7-16)9-4-1-2-5-11(9)15-13(10)17/h1-2,4-5H,3,6-7H2,(H,15,17)
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
5.55E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Corp

US Patent


Assay Description
Rhesus PDE9A2 was amplified from rhesus whole brain cDNA (Biochain Institute) essentially as described in Hutson, et al. Neuropharmacology (2011) 61(...


US Patent US10376504 (2019)


BindingDB Entry DOI: 10.7270/Q2XK8HX6
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%