BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'GTPase KRas [G12C]' and Ligand = 'BDBM609006'   
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 [G12C]


(Homo sapiens (Human))
BDBM609006
PNG
(US11702409, Example 76a | US11702409, Example 76b)
Show SMILES Cc1c(c(nn1C1CC2(C1)CN(C2)C(=O)C=C)-c1ccc2N(CCc2c1)C(=N)CN1CC[C@H](F)C1)-c1c(Cl)c(C)cc2[nH]ncc12 |r,wU:32.37,(-2.78,3.57,;-1.53,2.66,;-1.53,1.12,;-.07,.65,;.84,1.89,;-.07,3.14,;.33,4.63,;1.67,5.4,;.9,6.73,;-.44,5.96,;2.23,7.5,;1.46,8.83,;.13,8.06,;1.86,10.32,;.77,11.41,;3.35,10.72,;4.43,9.63,;.33,-.84,;-.07,-2.33,;1.02,-3.42,;2.51,-3.02,;3.8,-3.86,;5,-2.89,;4.45,-1.45,;2.91,-1.53,;1.82,-.44,;3.8,-5.4,;2.47,-6.17,;5.14,-6.17,;5.14,-7.71,;3.89,-8.61,;4.37,-10.08,;5.91,-10.08,;6.68,-11.41,;6.38,-8.61,;-2.78,.22,;-2.62,-1.31,;-1.53,-2.4,;-3.86,-2.22,;-3.7,-3.75,;-5.27,-1.59,;-5.43,-.06,;-6.68,.84,;-6.2,2.31,;-4.66,2.31,;-4.18,.84,)|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 15n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8HXK
More data for this
Ligand-Target Pair
GTPase KRas [G12C]


(Homo sapiens (Human))
BDBM609006
PNG
(US11702409, Example 76a | US11702409, Example 76b)
Show SMILES Cc1c(c(nn1C1CC2(C1)CN(C2)C(=O)C=C)-c1ccc2N(CCc2c1)C(=N)CN1CC[C@H](F)C1)-c1c(Cl)c(C)cc2[nH]ncc12 |r,wU:32.37,(-2.78,3.57,;-1.53,2.66,;-1.53,1.12,;-.07,.65,;.84,1.89,;-.07,3.14,;.33,4.63,;1.67,5.4,;.9,6.73,;-.44,5.96,;2.23,7.5,;1.46,8.83,;.13,8.06,;1.86,10.32,;.77,11.41,;3.35,10.72,;4.43,9.63,;.33,-.84,;-.07,-2.33,;1.02,-3.42,;2.51,-3.02,;3.8,-3.86,;5,-2.89,;4.45,-1.45,;2.91,-1.53,;1.82,-.44,;3.8,-5.4,;2.47,-6.17,;5.14,-6.17,;5.14,-7.71,;3.89,-8.61,;4.37,-10.08,;5.91,-10.08,;6.68,-11.41,;6.38,-8.61,;-2.78,.22,;-2.62,-1.31,;-1.53,-2.4,;-3.86,-2.22,;-3.7,-3.75,;-5.27,-1.59,;-5.43,-.06,;-6.68,.84,;-6.2,2.31,;-4.66,2.31,;-4.18,.84,)|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 1.33E+4n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8HXK
More data for this
Ligand-Target Pair