BDBM50579095 CHEMBL4851139

SMILES C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCN)NC(=O)[C@@H]1CNC(=O)c2cc3cc(c2)C(=O)N[C@H](Cc2ccc4ccccc4c2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](Cc2ccc4ccccc4c2)C(=O)N[C@@H](c2ccccc2)C(=O)N[C@@H](CCCCNC3=O)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1)C(N)=O

InChI Key InChIKey=ZQTIVTBIQLGVTK-CMLVFNFRSA-N

Data  4 IC50  4 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 8 hits for monomerid = 50579095   

TargetGTPase KRas(Homo sapiens (Human))
The Ohio State University

Curated by ChEMBL
LigandPNGBDBM50579095(CHEMBL4851139)
Affinity DataIC50:  690nMAssay Description:Inhibition of His6-tagged KRas G12V mutant (unknown origin) expressed in Escherichia coli BL21(DE3) cells assessed as reduction in Ras/GST-fused Raf ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetGTPase KRas(Homo sapiens (Human))
The Ohio State University

Curated by ChEMBL
LigandPNGBDBM50579095(CHEMBL4851139)
Affinity DataKd:  42nMAssay Description:Binding affinity to GTPgammaS bound His6-tagged KRas G12V mutant (unknown origin) incubated for 1 hr by fluorescence polarizationMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetGTPase KRas(Homo sapiens (Human))
The Ohio State University

Curated by ChEMBL
LigandPNGBDBM50579095(CHEMBL4851139)
Affinity DataKd:  21nMAssay Description:Binding affinity to GppNHp bound His6-tagged KRas G12V mutant (unknown origin) incubated for 1 hr by fluorescence polarizationMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetGTPase KRas(Homo sapiens (Human))
The Ohio State University

Curated by ChEMBL
LigandPNGBDBM50579095(CHEMBL4851139)
Affinity DataIC50:  3.00E+3nMAssay Description:Inhibition of KRas signaling in EGF-stimulated human NCI-H358 cells assessed as reduction in MEK phosphorylation preincubated for 4 hrs followed by E...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetAlbumin(Bos taurus)
The Ohio State University

Curated by ChEMBL
LigandPNGBDBM50579095(CHEMBL4851139)
Affinity DataKd:  5.70E+4nMAssay Description:Binding affinity to bovine serum albuminMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetGTPase KRas(Homo sapiens (Human))
The Ohio State University

Curated by ChEMBL
LigandPNGBDBM50579095(CHEMBL4851139)
Affinity DataIC50:  3.00E+3nMAssay Description:Inhibition of KRas signaling in EGF-stimulated human NCI-H358 cells assessed as reduction in Akt phosphorylation at ser473 residue preincubated for 4...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetGTPase KRas(Homo sapiens (Human))
The Ohio State University

Curated by ChEMBL
LigandPNGBDBM50579095(CHEMBL4851139)
Affinity DataIC50:  3.00E+3nMAssay Description:Inhibition of KRas signaling in EGF-stimulated human NCI-H358 cells assessed as reduction in Akt phosphorylation at thr308 residue preincubated for 4...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetGTPase KRas(Homo sapiens (Human))
The Ohio State University

Curated by ChEMBL
LigandPNGBDBM50579095(CHEMBL4851139)
Affinity DataKd:  230nMAssay Description:Binding affinity to GDP bound His6-tagged KRas G12V mutant (unknown origin) incubated for 1 hr by fluorescence polarizationMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed