BDBM50598695 CHEMBL5174952

SMILES C[C@H](C(=O)N1CC[C@]2(C1)CCc1cc(c(C)nc1N2)-c1ncccn1)c1ccc(OC(F)F)nc1

InChI Key InChIKey=WPKUZQXLQKEKKU-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50598695   

TargetMelanocortin receptor 4(Human)
Arrival Discovery

Curated by ChEMBL
LigandPNGBDBM50598695(CHEMBL5174952 | US20250084084, Example 6)
Affinity DataKi:  0.440nMAssay Description:Displacement of [125I]-[Nle4-D-phe7]-alpha-MSH from to human MC4R expressed in CHO cells incubated for 2 hrs by liquid scintillation counting methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/23/2023
Entry Details
PubMed
TargetMelanocortin receptor 4(Human)
Arrival Discovery

Curated by ChEMBL
LigandPNGBDBM50598695(CHEMBL5174952 | US20250084084, Example 6)
Affinity DataKi:  0.440nMAssay Description:The binding affinity of test compounds at the α-melanocyte-stimulating hormone receptor (hMC4R) was assessed using a radioligand competition binding ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/17/2025
Entry Details
US Patent

TargetMelanocortin receptor 4(Human)
Arrival Discovery

Curated by ChEMBL
LigandPNGBDBM50598695(CHEMBL5174952 | US20250084084, Example 6)
Affinity DataKi: >200nMAssay Description:Compounds were solubilized in 100% dimethyl sulfoxide (DMSO) to a concentration of 30 mM. A 10-point intermediate dilution series using half log dilu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/20/2025
Entry Details
US Patent