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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Poly [ADP-ribose] polymerase tankyrase-2' and Ligand = 'BDBM657051'   
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
Poly [ADP-ribose] polymerase tankyrase-2


(Homo sapiens (Human))
BDBM657051
PNG
(US11926614, Example 56)
Show SMILES CCOc1ccc(nc1)-c1nnc([C@H]2C[C@@H](C2)NC(=O)c2ccc(F)cc2)n1-c1ccccc1F |r,wU:15.18,wD:13.13,(-11.1,-3.18,;-9.85,-2.28,;-8.44,-2.9,;-7.2,-2,;-5.79,-2.63,;-4.55,-1.72,;-4.71,-.19,;-6.11,.44,;-7.36,-.47,;-3.46,.72,;-3.46,2.26,;-2,2.73,;-1.09,1.49,;.45,1.49,;1.54,.4,;2.63,1.49,;1.54,2.58,;4.17,1.49,;4.94,2.82,;4.17,4.15,;6.48,2.82,;7.25,1.49,;8.79,1.49,;9.56,2.82,;11.1,2.82,;8.79,4.15,;7.25,4.15,;-2,.24,;-1.52,-1.22,;-2.55,-2.37,;-2.07,-3.83,;-.57,-4.15,;.46,-3.01,;-.01,-1.54,;1.02,-.4,)|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 2n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Poly [ADP-ribose] polymerase tankyrase-2


(Homo sapiens (Human))
BDBM657051
PNG
(US11926614, Example 56)
Show SMILES CCOc1ccc(nc1)-c1nnc([C@H]2C[C@@H](C2)NC(=O)c2ccc(F)cc2)n1-c1ccccc1F |r,wU:15.18,wD:13.13,(-11.1,-3.18,;-9.85,-2.28,;-8.44,-2.9,;-7.2,-2,;-5.79,-2.63,;-4.55,-1.72,;-4.71,-.19,;-6.11,.44,;-7.36,-.47,;-3.46,.72,;-3.46,2.26,;-2,2.73,;-1.09,1.49,;.45,1.49,;1.54,.4,;2.63,1.49,;1.54,2.58,;4.17,1.49,;4.94,2.82,;4.17,4.15,;6.48,2.82,;7.25,1.49,;8.79,1.49,;9.56,2.82,;11.1,2.82,;8.79,4.15,;7.25,4.15,;-2,.24,;-1.52,-1.22,;-2.55,-2.37,;-2.07,-3.83,;-.57,-4.15,;.46,-3.01,;-.01,-1.54,;1.02,-.4,)|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 10n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair