BDBM50667723 CHEMBL6189671::US20260132140, Example 98

SMILES C[C@@H]1C[C@@H](N2CCC2)CN1c1ccc(-n2cnc(Nc3cnc(C#N)cn3)c2)cc1

InChI Key InChIKey=YESDHPCMNPYCFZ-UHFFFAOYSA-N

Data  8 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50667723   

TargetSerine/threonine-protein kinase Chk1(Human)
BenevolentAI

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50667723BDBM50667723(CHEMBL6189671 | US20260132140, Example 98)
Affinity DataIC50: 1nMAssay Description:Inhibition of N-terminal GST-fused human full length CHK1 (1 to 476 residues) expressed in baculovirus-infected Sf21 cells using STK1 S1 as substrate...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetSerine/threonine-protein kinase Chk1(Human)
BenevolentAI

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50667723BDBM50667723(CHEMBL6189671 | US20260132140, Example 98)
Affinity DataIC50: 10nMAssay Description:Table 20: 2 μL enzyme/substrate solution (1 nM Chk-1 (Carna Bioscience #02-177), in solution with 30 μM ATP, 4 μM STK1 S1 (Cisbio #62ST1PEB) in assay...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
9/23/2026
Entry Details
US Patent

TargetRibosomal protein S6 kinase alpha-2 (RSK3)(Human)
Benevolentai Bio

US Patent
LigandChemical structure of BindingDB Monomer ID 50667723BDBM50667723(CHEMBL6189671 | US20260132140, Example 98)
Affinity DataIC50: 651nMAssay Description:Table 24: Selected compounds of the invention were tested for their inhibitory potential of RSK1, RSK2, RSK3 and RSK4 kinases via the Eurofins Kinase...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
9/23/2026
Entry Details
US Patent

TargetRibosomal protein S6 kinase alpha-3(Human)
Benevolentai Bio

US Patent
LigandChemical structure of BindingDB Monomer ID 50667723BDBM50667723(CHEMBL6189671 | US20260132140, Example 98)
Affinity DataIC50: 786nMAssay Description:Table 24: Selected compounds of the invention were tested for their inhibitory potential of RSK1, RSK2, RSK3 and RSK4 kinases via the Eurofins Kinase...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
9/23/2026
Entry Details
US Patent

TargetRibosomal protein S6 kinase alpha-6(Human)
Benevolentai Bio

US Patent
LigandChemical structure of BindingDB Monomer ID 50667723BDBM50667723(CHEMBL6189671 | US20260132140, Example 98)
Affinity DataIC50: 2.47E+3nMAssay Description:Table 24: Selected compounds of the invention were tested for their inhibitory potential of RSK1, RSK2, RSK3 and RSK4 kinases via the Eurofins Kinase...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
9/23/2026
Entry Details
US Patent

TargetSerine/threonine-protein kinase Chk2(Human)
BenevolentAI

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50667723BDBM50667723(CHEMBL6189671 | US20260132140, Example 98)
Affinity DataIC50: 3.07E+3nMAssay Description:Inhibition of N-terminal GST-fused human full length CHK2 (1 to 543 residues) expressed in baculovirus-infected Sf21 cells using STK1 S1 as substrate...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetRibosomal protein S6 kinase alpha-1(Human)
Benevolentai Bio

US Patent
LigandChemical structure of BindingDB Monomer ID 50667723BDBM50667723(CHEMBL6189671 | US20260132140, Example 98)
Affinity DataIC50: 3.55E+3nMAssay Description:Table 24: Selected compounds of the invention were tested for their inhibitory potential of RSK1, RSK2, RSK3 and RSK4 kinases via the Eurofins Kinase...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
9/23/2026
Entry Details
US Patent

TargetSerine/threonine-protein kinase Chk2(Human)
BenevolentAI

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50667723BDBM50667723(CHEMBL6189671 | US20260132140, Example 98)
Affinity DataIC50: 5.50E+3nMAssay Description:Table 23: 2 μL enzyme/substrate solution (2 nM Chk-1 (Carna Bioscience #02-162), in solution with 200 μM ATP, 4 μM STK1 S1 (Cisbio #62ST1PEB) in assa...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
9/23/2026
Entry Details
US Patent