BDBM642371 US20230406840, Example 45

SMILES CCOC1(CC1)c1ccc2nccc(C(=O)NCC(=O)N3[C@H]4C[C@H]4C[C@H]3C#N)c2c1

InChI Key InChIKey=BQINSBJAWALJNI-UHFFFAOYSA-N

Data  3 IC50  1 Kd

  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 4 hits for monomerid = 642371   

TargetProlyl endopeptidase FAP(Human)
Astrazeneca

US Patent
LigandPNGBDBM642371(US20230406840, Example 45)
Affinity DataIC50: 0.760nMAssay Description:Table 1A: Compounds were tested in a biochemical inhibition assay using hFAP enzyme at 0.24 nM FAC (Proteros, 38-760 (PR-0071)) and the substrate Ala...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2024
Entry Details
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TargetProlyl endopeptidase FAP(Human)
Astrazeneca

US Patent
LigandPNGBDBM642371(US20230406840, Example 45)
Affinity DataIC50: 0.25nMAssay Description:Table 1A: Compounds were tested in a biochemical inhibition assay using human Fibroblast activation protein alpha (hFAP) enzyme at 2.4 μM FAC (P...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2024
Entry Details
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TargetProlyl endopeptidase FAP(Human)
Astrazeneca

US Patent
LigandPNGBDBM642371(US20230406840, Example 45)
Affinity DataKd:  7.30nMAssay Description:Table 1B: Compounds were tested in a direct binding assay using 8K surface plasmon resonance biosensor (GE Healthcare) at 20° C. Immobilization of hF...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2024
Entry Details
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TargetPresequence protease, mitochondrial(Human)
Astrazeneca

US Patent
LigandPNGBDBM642371(US20230406840, Example 45)
Affinity DataIC50: 5.00E+4nMAssay Description:Table 3: Compounds were tested in a biochemical inhibition assay using Prolyl endopeptidase, Prolyl Oligopeptidase (hPREP) enzyme at 0.6 nM FAC (R&D ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2024
Entry Details
Go to US Patent