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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'GTPase KRas [1-169,G12C,C118A]/Son of sevenless homolog 1 [564-1049]' and Ligand = 'BDBM653019'   
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
GTPase KRas [1-169,G12C,C118A]/Son of sevenless homolog 1 [564-1049]


(Homo sapiens (Human))
BDBM653019
PNG
((M)-1-(6- ((1S,8R)-5- methyl-6-(1,5,6- trimethyl-1...)
Show SMILES Cc1cc2cnn(C)c2c(c1C)-c1c2[C@@H]3CC[C@@H](C3)c2nc(N2CCC3(CN(C3)C(=O)C=C)C2)c1C |r,wU:17.19,14.20,(5.55,-3.51,;4.22,-4.28,;4.22,-5.82,;2.88,-6.59,;2.56,-8.1,;1.03,-8.26,;.41,-6.85,;-1.08,-6.45,;1.55,-5.82,;1.55,-4.28,;2.88,-3.51,;2.88,-1.97,;.22,-3.51,;-1.12,-4.28,;-1.12,-5.82,;-2.45,-6.59,;-3.78,-5.82,;-3.78,-4.28,;-2.3,-4.68,;-2.45,-3.51,;-2.45,-1.97,;-1.12,-1.2,;-1.12,.34,;.13,1.24,;-.35,2.71,;-1.89,2.71,;-1.49,4.2,;-2.98,4.59,;-3.37,3.11,;-4.06,5.68,;-5.55,5.28,;-3.67,7.17,;-4.75,8.26,;-2.36,1.24,;.22,-1.97,;1.55,-1.2,)|
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n/an/a 3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair