BDBM685763 US12043602, Compound 15a::US12043602, Compound NY0244a::US12043602, Compound NY0454

SMILES [#6]-[#8]-c1ccc(cc1)-[#6@H](-[#6])-[#7](-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#7](-[#6])-[#6]-[#6]-1)-[#6]\[#6]=[#6](/c1ccccc1)-c1ccccc1

InChI Key InChIKey=NZNBIFCXBANXNS-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 685763   

TargetGTPase KRas [G12V](Human)
University of Texas

US Patent
LigandPNGBDBM685763(US12043602, Compound 15a | US12043602, Compound NY...)
Affinity DataIC50: 190nMAssay Description:Table 1: Potency and efficacy of K-RAS inhibition and toxicity of batch1 and 2 compounds. MDCK cells co-expressing GFP-K-RASG12V and mCherry-CAAX wer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/4/2024
Entry Details
Go to US Patent

TargetGTPase KRas [G12V](Human)
University of Texas

US Patent
LigandPNGBDBM685763(US12043602, Compound 15a | US12043602, Compound NY...)
Affinity DataIC50: 1.24E+3nMAssay Description:Table 3: Potency and efficacy K-RAS inhibition and toxicity of batch 3 compounds. MDCK cells co-expressing GFP-K-RASG12V and mCherry-CAAX were grown ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/4/2024
Entry Details
Go to US Patent

TargetGTPase KRas [G12V](Human)
University of Texas

US Patent
LigandPNGBDBM685763(US12043602, Compound 15a | US12043602, Compound NY...)
Affinity DataIC50: 1.20E+3nMAssay Description:Table 9: IC50: 50% inhibitory concentration for KRASG12V mislocalization. Values were calculated from at least eight data points. In general, at leas...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/4/2024
Entry Details
Go to US Patent