BDBM50628058 CHEMBL5439556::US20240327434, Compound 9-p1

SMILES [H][C@]12CC[C@]([H])(N1)[C@@]1([H])COc3nc(c(F)c4nc(OC[C@@]56CCCN5C[C@H](F)C6)nc(N1C2)c34)-c1cc(O)cc2ccc(F)c(CC)c12

InChI Key InChIKey=XLWBILUNGOIIFR-UHFFFAOYSA-N

Data  1 IC50  2 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50628058   

TargetGTPase KRas [G12D](Human)
Jiangsu Hengrui Pharmaceuticals

US Patent
LigandPNGBDBM50628058(US20240327434, Compound 9-p1 | CHEMBL5439556)
Affinity DataKd:  0.0300nMAssay Description:Biotinylated Avi-KRAS-WT or Avi-KRAS-G12D was diluted to 20 μg/mL with 1x HBS-P+(Cat. #BR1006-71) buffer containing 100 mM MgCl2, and then flowe...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/3/2025
Entry Details
US Patent

TargetPlatelet-derived growth factor receptor alpha/beta(Mouse)
Usona Institute

Curated by ChEMBL
LigandPNGBDBM50628058(US20240327434, Compound 9-p1 | CHEMBL5439556)
Affinity DataIC50: 0.760nMAssay Description:Inhibition of ERK1/2 phosphorylation in human PANC-1 cells incubated for 3 hrsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2024
Entry Details
PubMed
TargetGTPase KRas(Human)
Jiangsu Hengrui Pharmaceuticals

US Patent
LigandPNGBDBM50628058(US20240327434, Compound 9-p1 | CHEMBL5439556)
Affinity DataKd:  1.54nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/3/2025
Entry Details
US Patent