Found 2 hits Enz. Inhib. hit(s) with Target = 'GTPase KRas [G12C]' and Ligand = 'BDBM608872' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
GTPase KRas [G12C]
(Homo sapiens (Human)) | BDBM608872
(US11702409, Example 21a | US11702409, Example 21b)Show SMILES CN1Cc2cc(ccc2CC1=O)-c1nn(C2CC3(C2)CN(C3)C(=O)C=C)c(C)c1-c1c(Cl)c(C)cc2[nH]ncc12 |(5.3,-8.09,;4.98,-6.59,;3.52,-6.11,;3.2,-4.6,;1.73,-4.13,;1.41,-2.62,;2.56,-1.59,;4.02,-2.07,;4.34,-3.57,;5.81,-4.05,;6.13,-5.55,;7.59,-6.03,;-.05,-2.14,;-.53,-.68,;-2.07,-.68,;-2.84,.65,;-4.32,1.05,;-3.93,2.54,;-2.44,2.14,;-5.41,2.94,;-5.02,4.43,;-3.53,4.03,;-6.1,5.51,;-7.59,5.12,;-5.71,7,;-6.79,8.09,;-2.54,-2.14,;-4.01,-2.62,;-1.3,-3.05,;-1.3,-4.59,;-2.63,-5.36,;-3.96,-4.59,;-2.63,-6.9,;-3.96,-7.67,;-1.3,-7.67,;.04,-6.9,;1.5,-7.38,;2.41,-6.13,;1.5,-4.88,;.04,-5.36,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| | n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20V8HXK |
More data for this
Ligand-Target Pair | |
GTPase KRas [G12C]
(Homo sapiens (Human)) | BDBM608872
(US11702409, Example 21a | US11702409, Example 21b)Show SMILES CN1Cc2cc(ccc2CC1=O)-c1nn(C2CC3(C2)CN(C3)C(=O)C=C)c(C)c1-c1c(Cl)c(C)cc2[nH]ncc12 |(5.3,-8.09,;4.98,-6.59,;3.52,-6.11,;3.2,-4.6,;1.73,-4.13,;1.41,-2.62,;2.56,-1.59,;4.02,-2.07,;4.34,-3.57,;5.81,-4.05,;6.13,-5.55,;7.59,-6.03,;-.05,-2.14,;-.53,-.68,;-2.07,-.68,;-2.84,.65,;-4.32,1.05,;-3.93,2.54,;-2.44,2.14,;-5.41,2.94,;-5.02,4.43,;-3.53,4.03,;-6.1,5.51,;-7.59,5.12,;-5.71,7,;-6.79,8.09,;-2.54,-2.14,;-4.01,-2.62,;-1.3,-3.05,;-1.3,-4.59,;-2.63,-5.36,;-3.96,-4.59,;-2.63,-6.9,;-3.96,-7.67,;-1.3,-7.67,;.04,-6.9,;1.5,-7.38,;2.41,-6.13,;1.5,-4.88,;.04,-5.36,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q20V8HXK |
More data for this
Ligand-Target Pair | |
Search and Browse
