BDBM50501944 CHEMBL4464994

SMILES CN[C@@H](C)C(=O)N[C@@H](CCCNC(=O)c1ccc(cc1)S(F)(=O)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O

InChI Key InChIKey=AMRVVLGYSQKIMV-UHFFFAOYSA-N

Data  14 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 50501944   

TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 12nMAssay Description:Covalent binding affinity to N-terminal His tagged recombinant human XIAP-BIR3 domain (253 to 347 residues) expressed in Escherichia coli BL21(DE3) c...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 15nMAssay Description:Covalent binding affinity to N-terminal His tagged recombinant human XIAP-BIR3 domain (253 to 347 residues) expressed in Escherichia coli BL21(DE3) c...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 63nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 Lys311Tyr mutant expressed in Escherichia coli BL21(DE3) cel...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 85nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 Lys311Tyr mutant expressed in Escherichia coli BL21(DE3) cel...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 89nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 Lys311Ala mutant expressed in Escherichia coli BL21(DE3) cel...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 100nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 domain (253 to 347 residues) expressed in Escherichia coli B...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 108nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 Lys311Ala mutant expressed in Escherichia coli BL21(DE3) cel...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 130nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 Lys311His mutant expressed in Escherichia coli BL21(DE3) cel...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 140nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 Lys311His mutant expressed in Escherichia coli BL21(DE3) cel...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 140nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 domain (253 to 347 residues) expressed in Escherichia coli B...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 220nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 Lys311Thr mutant expressed in Escherichia coli BL21(DE3) cel...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 240nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 Lys311Thr mutant expressed in Escherichia coli BL21(DE3) cel...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 250nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 Lys311Ser mutant expressed in Escherichia coli BL21(DE3) cel...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed
TargetE3 ubiquitin-protein ligase XIAP(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50501944(CHEMBL4464994)
Affinity DataIC50: 276nMAssay Description:Displacement of biotinylated AVPF from N-terminal His tagged recombinant human XIAP-BIR3 Lys311Ser mutant expressed in Escherichia coli BL21(DE3) cel...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2021
Entry Details Article
PubMed