BDBM50601517 CHEMBL5181611

SMILES CN1CCN(CC1)c1ccc(cc1NC(=O)c1c[nH]c(=O)cc1C(F)(F)F)-c1ccc(cc1)C(=O)NCCOCCNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12

InChI Key InChIKey=CCAKBASGLWLWPO-UHFFFAOYSA-N

Data  2 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 3 hits for monomerid = 50601517   

TargetWD repeat-containing protein 5(Human)
Goethe University Frankfurt Am Main

Curated by ChEMBL
LigandPNGBDBM50601517(CHEMBL5181611)
Affinity DataIC50: 990nMAssay Description:Displacement of N-(4'-((17-(5,5-difluoro-7-(1H-pyrrol-2-yl)-5H-5l4,6l4-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-3-yl)-15-oxo-4,7,10-trioxa-14-azah...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMed
TargetWD repeat-containing protein 5(Human)
Goethe University Frankfurt Am Main

Curated by ChEMBL
LigandPNGBDBM50601517(CHEMBL5181611)
Affinity DataIC50: 4.30E+3nMAssay Description:Displacement of N-(4'-((17-(5,5-difluoro-7-(1H-pyrrol-2-yl)-5H-5l4,6l4-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-3-yl)-15-oxo-4,7,10-trioxa-14-azah...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMed
TargetWD repeat-containing protein 5(Human)
Goethe University Frankfurt Am Main

Curated by ChEMBL
LigandPNGBDBM50601517(CHEMBL5181611)
Affinity DataKd:  1.20E+4nMAssay Description:Binding affinity to recombinant WDR5 (unknown origin) expressed in Escherichia coli BL21 assessed as dissociation constant by isothermal titration ca...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMed