BDBM576791 4-(1-(2-Chloro-4- ((methylamino)methyl)phenyl)- 1H-pyrazol-4-yl)-2-((1- (methylsulfonyl)piperidin- 4-yl)amino)pyrimidine- 5-carbonitrile::US11472791, Example 113::US11472791, Example 138

SMILES CNCc1ccc(c(Cl)c1)-n1cc(cn1)-c1nc(NC2CCN(CC2)S(C)(=O)=O)ncc1C#N

InChI Key InChIKey=QTEXRPQBMDQPDE-UHFFFAOYSA-N

Data  2 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 11 hits for monomerid = 576791   

LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 0.420nMAssay Description:Inhibition of N-terminal GST-tagged full-length human CDK2(1 to 298 residues) /FLAG-tagged human Cyclin E1 (1 to 410 residues) expressed in baculovir...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 8.10nMAssay Description:Inhibition of N-terminal GST-tagged human CDK4 (4 to 303 residues)/N-terminal GST-tagged human Cyclin D1 (4 to 295 residues) expressed in Sf9 insect ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetCyclin-dependent kinase 2(Human)
Incyte

Curated by ChEMBL
LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 18nMAssay Description:Inhibition of CDK2 in CCNE1-amplified human COV318 cells assessed as reduction in retinoblastoma protein phosphorylation at S780 residue incubated ov...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 31nMAssay Description:Inhibition of N-terminal GST-tagged human CDK6 (1 to 326 residues)/N-terminal 6-His fused human Cyclin D3 (1 to 292 residues) expressed in Sf9 insect...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 50nMAssay Description:CDK2/Cyclin E1 enzyme activity assays utilize full-length human CDK2 co-expressed as N-terminal GST-tagged protein with FLAG-Cyclin E1 in a baculovir...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/23/2022
Entry Details
US Patent

LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 50nMAssay Description:CDK2/Cyclin E1 enzyme activity assays utilize full-length human CDK2 co-expressed as N-terminal GST-tagged protein with FLAG-Cyclin E1 in a baculovir...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/23/2022
Entry Details
US Patent

TargetCyclin-dependent kinase 2(Human)
Incyte

Curated by ChEMBL
LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 112nMAssay Description:Inhibition of CDK2 in human whole blood spiked with CCNE1-amplified human COV318 cells assessed as reduction in retinoblastoma protein phosphorylatio...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 120nMAssay Description:Inhibition of N-terminal GST-tagged full length human CDK1 (1 to 297 residues)/human Cyclin B1 (1 to 433 residues) expressed in baculovirus infected ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetCyclin-dependent kinase 1(Human)
Incyte

Curated by ChEMBL
LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 225nMAssay Description:Inhibition of CDK1 in human OVCAR-3 cells assessed as reduction in nucleophosmin phosphorylation at T199 residue incubated for 30 mins by In-cell wes...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 333nMAssay Description:Inhibition of C-terminal 6-His tagged recombinant full-length human CDK7/recombinant full-length human Cyclin H/N-terminal GST-tagged recombinant ful...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
LigandPNGBDBM576791(US11472791, Example 113 | 4-(1-(2-Chloro-4- ((meth...)
Affinity DataIC50: 2.97E+3nMAssay Description:Inhibition of N-terminal GST-tagged full length human CDK9 (1 to 372 residues)/His-tagged human Cyclin T1 (1 to 726 residues) expressed in baculoviru...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed