BDBM707908 (1r,2R,3S)-N-[(7S,13S)-(20M)-20-[5-(4-ethylpiperazin-1-yl)-2-[(1S)-1-methoxyethyl]-3-pyridyl]-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,30,31-tetrazahexacyclo[23.3.1.12,5.19,13.019,27.021,26]hentriaconta-1 (28),2,5 (31), 19,25 ::US20240417410, Example 113

SMILES CCN1CCN(c2cnc([C@H](C)OC)c(-c3c4c5cc(cc6c5n3CCC6)-c3csc(n3)C[C@H](NC(=O)[C@H]3[C@H](C)[C@@H]3C)C(=O)N3CCC[C@H](N3)C(=O)OCC(C)(C)C4)c2)CC1

InChI Key InChIKey=XWPONBNTDPSDAM-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 707908   

LigandPNGBDBM707908((1r,2R,3S)-N-[(7S,13S)-(20M)-20-[5-(4-ethylpiperaz...)
Affinity DataIC50: 4.30nMAssay Description:In this example, TR-FRET was also used to measure the compound or compound-CYPA dependent disruption of the KRAS G12C-BRAF complex. This protocol was...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
5/1/2025
Entry Details
Go to US Patent

LigandPNGBDBM707908((1r,2R,3S)-N-[(7S,13S)-(20M)-20-[5-(4-ethylpiperaz...)
Affinity DataIC50: 3.80E+4nMAssay Description:In this example, TR-FRET was also used to measure the compound or compound-CYPA dependent disruption of the KRAS G12C-BRAF complex. This protocol was...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
5/1/2025
Entry Details
Go to US Patent

LigandPNGBDBM707908((1r,2R,3S)-N-[(7S,13S)-(20M)-20-[5-(4-ethylpiperaz...)
Affinity DataIC50: 5.60E+3nMAssay Description:In this example, TR-FRET was also used to measure the compound or compound-CYPA dependent disruption of the KRAS G12C-BRAF complex. This protocol was...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
5/1/2025
Entry Details
Go to US Patent