BDBM50617052 CHEMBL5411999::US20250129048, Example 7

SMILES COc1cc([C@@H](C)C(=O)N2CC[C@@H](C2)Nc2ccc(-c3nc(C(F)F)n(C)n3)c(C)n2)c(F)cn1

InChI Key InChIKey=ADBIDSWNOQWYKU-UHFFFAOYSA-N

Data  3 KI  2 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 5 hits for monomerid = 50617052   

LigandPNGBDBM50617052(CHEMBL5411999 | US20250129048, Example 7)
Affinity DataIC50: 2.50E+4nMAssay Description:Inhibition of hERG expressed in CHO cells stably at -80 mV holding potential by automated patch clamp methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2024
Entry Details
PubMed
LigandPNGBDBM50617052(CHEMBL5411999 | US20250129048, Example 7)
Affinity DataIC50: 2.80E+4nMAssay Description:Inhibition of hERG expressed in CHO cells stably at -80 mV holding potential by automated patch clamp methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2024
Entry Details
PubMed
TargetMelanocortin receptor 4(Human)
Pfizer

Curated by ChEMBL
LigandPNGBDBM50617052(CHEMBL5411999 | US20250129048, Example 7)
Affinity DataKi:  0.460nMAssay Description:Antagonist activity at human MC4R in CHO cells measured for 24 hrs in presence of alpha-MSHMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2024
Entry Details
PubMed
TargetMelanocortin receptor 4(Human)
Pfizer

Curated by ChEMBL
LigandPNGBDBM50617052(CHEMBL5411999 | US20250129048, Example 7)
Affinity DataKi:  0.770nMAssay Description:Antagonist activity at human MC4R in CHO cells measured for 24 hrs in presence of alpha-MSHMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2024
Entry Details
PubMed
TargetMelanocortin receptor 4(Human)
Pfizer

Curated by ChEMBL
LigandPNGBDBM50617052(CHEMBL5411999 | US20250129048, Example 7)
Affinity DataKi:  0.770nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2025
Entry Details
Go to US Patent