BDBM50517187 CHEMBL4464335::US11053226, Example 1-7

SMILES COc1cccc2CN(CCc12)C(=O)c1c(C2CC2)n(CC(=O)NC2CN(C2)C(=O)C=C)c2c(C)cc(Cl)cc12

InChI Key InChIKey=JESBUJUEMLEHDQ-UHFFFAOYSA-N

Data  5 IC50  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50517187   

TargetGTPase KRas(Homo sapiens (Human))
Amgen

Curated by ChEMBL
LigandPNGBDBM50517187(CHEMBL4464335 | US11053226, Example 1-7)
Affinity DataIC50:  219nMAssay Description:Inhibition of KRAS G12C mutant in human MIAPaCa2 cells assessed as reduction in EGF-induced ERK1/2 phosphorylation incubated for 4 hrs followed by EG...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGTPase KRas(Homo sapiens (Human))
Amgen

Curated by ChEMBL
LigandPNGBDBM50517187(CHEMBL4464335 | US11053226, Example 1-7)
Affinity DataKd:  2.00E+4nMAssay Description:Binding affinity to KRAS (unknown origin) by H-ddNMR analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGTPase KRas [1-169,G12C,C118A](Homo sapiens (Human))
Amgen

US Patent
LigandPNGBDBM50517187(CHEMBL4464335 | US11053226, Example 1-7)
Affinity DataIC50:  110nMAssay Description:Purified GDP-bound KRAS protein (aa 1-169), containing both G12C and C118A amino acid substitutions and an N-terminal His-tag, was pre-incubated in a...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetGTPase KRas(Homo sapiens (Human))
Amgen

Curated by ChEMBL
LigandPNGBDBM50517187(CHEMBL4464335 | US11053226, Example 1-7)
Affinity DataIC50:  115nMAssay Description:Inhibition of GDP bound N terminal His-tagged KRAS G12C/C118A mutant (unknown origin) (1 to 169 residues) assessed as reduction in SOS-mediated guani...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGTPase KRas [1-169,G12C,C118A](Homo sapiens (Human))
Amgen

US Patent
LigandPNGBDBM50517187(CHEMBL4464335 | US11053226, Example 1-7)
Affinity DataIC50:  110nMAssay Description:Purified GDP-bound KRAS protein (aa 1-169), containing both G12C and C118A amino acid substitutions and an N-terminal His-tag, was pre-incubated in a...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetGTPase KRas(Homo sapiens (Human))
Amgen

Curated by ChEMBL
LigandPNGBDBM50517187(CHEMBL4464335 | US11053226, Example 1-7)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of KRAS G12C mutant in human A549 cells assessed as reduction in EGF-induced ERK1/2 phosphorylation incubated for 4 hrs followed by EGF ad...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed