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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 489302   
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
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM489302
PNG
(Example 3-1 | US10961242, Compound 17 | US11548883...)
Show SMILES O=C(CN1CCc2[nH]nnc2C1)N1CCN(CC1)c1cnc(NC2Cc3ccccc3C2)nc1
Show InChI InChI=1S/C24H29N9O/c34-23(16-31-6-5-21-22(15-31)29-30-28-21)33-9-7-32(8-10-33)20-13-25-24(26-14-20)27-19-11-17-3-1-2-4-18(17)12-19/h1-4,13-14,19H,5-12,15-16H2,(H,25,26,27)(H,28,29,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3.40n/an/an/an/an/an/a


TBA

Assay Description
Two-fold dilution of each test compound solution (10 μM, 100% dimethyl sulfoxide) is carried out on 96-well V bottom plate (Costar 3363). After ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2F76HDX
More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Homo sapiens (Human))
BDBM489302
PNG
(Example 3-1 | US10961242, Compound 17 | US11548883...)
Show SMILES O=C(CN1CCc2[nH]nnc2C1)N1CCN(CC1)c1cnc(NC2Cc3ccccc3C2)nc1
Show InChI InChI=1S/C24H29N9O/c34-23(16-31-6-5-21-22(15-31)29-30-28-21)33-9-7-32(8-10-33)20-13-25-24(26-14-20)27-19-11-17-3-1-2-4-18(17)12-19/h1-4,13-14,19H,5-12,15-16H2,(H,25,26,27)(H,28,29,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3.40n/an/an/an/an/an/a



LegoChem Biosciences, Inc.

US Patent


Assay Description
Two-fold dilution of each test compound solution (10 μM, 100% dimethyl sulfoxide) is carried out on 96-well V bottom plate (Costar 3363). After ...


US Patent US10961242 (2021)


BindingDB Entry DOI: 10.7270/Q27084JN
More data for this
Ligand-Target Pair