BDBM50531074 CHEMBL4472649

SMILES CNC(=O)c1cc(cc(c1O)NS(=O)(=O)c2cc(cc(c2O)Cl)Br)C3(CCC3)C#N

InChI Key InChIKey=COYGYHFILXAMSQ-UHFFFAOYSA-N

Data  2 KI  2 Kd

PDB links: 1 PDB ID matches this monomer.

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50531074   

TargetWD repeat-containing protein 5(Human)
Vanderbilt University

Curated by ChEMBL
LigandPNGBDBM50531074(CHEMBL4472649)
Affinity DataKd:  69nMAssay Description:Displacement of FITC-labelled DEEEIDVVSVE from N-terminal SUMO-fused 6His-tagged WDR5 (unknown origin) (22 to 334 residues) expressed in Escherichia ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetWD repeat-containing protein 5(Human)
Vanderbilt University

Curated by ChEMBL
LigandPNGBDBM50531074(CHEMBL4472649)
Affinity DataKd:  69nMAssay Description:Displacement of FITC-labelled DEEEIDVVSVE from N-terminal SUMO-fused 6His-tagged WDR5 (unknown origin) (22 to 334 residues) expressed in Escherichia ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetWD repeat-containing protein 5(Human)
Vanderbilt University

Curated by ChEMBL
LigandPNGBDBM50531074(CHEMBL4472649)
Affinity DataKi:  107nMAssay Description:Competitive inhibition of WDR5 (unknown origin) assessed as inhibition constant in presence of 5-[({2-[2-({[(1S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(1S,2...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2024
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetWD repeat-containing protein 5(Human)
Vanderbilt University

Curated by ChEMBL
LigandPNGBDBM50531074(CHEMBL4472649)
Affinity DataKi: >4.00E+4nMAssay Description:Competitive inhibition of WDR5 (unknown origin) assessed as inhibition constant in presence of 5-{[(5S)-5-(6-{6-[(2S)-2-[(2S)-6-amino-2-[(2S)-5-carba...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2024
Entry Details
PubMedPDB3D3D Structure (crystal)