BDBM683991 US20240218021, Example 438

SMILES CC(C)C[C@@H]1NC(=O)[C@H](CCCCN(C)C(=O)[C@@H](C)NC(=O)[C@H](Cc2cc(Cl)ccc2Cl)N(C)C1=O)N(C)C(=O)[C@@H](NC(=O)[C@@H]1C[C@@H](F)CN1C(=O)[C@@](C)(O)C(F)(F)F)C1CC1

InChI Key InChIKey=HRAPBWAFBWHDJY-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 683991   

TargetCyclin-dependent kinase 1/G2/mitotic-specific cyclin-B(Spiny starfish)
Circle Pharma

US Patent
LigandPNGBDBM683991(US20240218021, Example 438)
Affinity DataIC50: 20nMAssay Description:FP binding assays were performed in 25 mM HEPES pH 7.5, 100 mM NaCl, 1 mM DTT, 0.01% NP-40 and 1 mg/mL BSA for all 3 protein complexes in black 96-we...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/12/2024
Entry Details
US Patent

TargetCyclin-A2/Cyclin-dependent kinase 2(Human)
Circle Pharma

US Patent
LigandPNGBDBM683991(US20240218021, Example 438)
Affinity DataIC50: 90nMAssay Description:FP binding assays were performed in 25 mM HEPES pH 7.5, 100 mM NaCl, 1 mM DTT, 0.01% NP-40 and 1 mg/mL BSA for all 3 protein complexes in black 96-we...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/12/2024
Entry Details
US Patent

TargetCyclin-dependent kinase 2/G1/S-specific cyclin-E1(Human)
Circle Pharma

US Patent
LigandPNGBDBM683991(US20240218021, Example 438)
Affinity DataIC50: 100nMAssay Description:FP binding assays were performed in 25 mM HEPES pH 7.5, 100 mM NaCl, 1 mM DTT, 0.01% NP-40 and 1 mg/mL BSA for all 3 protein complexes in black 96-we...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/12/2024
Entry Details
US Patent