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Compound Detail

CHEMBL3896173

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CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CNC(=O)CCC(=O)NCC[C@@H](C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O

Basic Information

ChEMBL ID CHEMBL3896173
Phase Preclinical
Structure Type MOL
InChI Key YZJAIULMUUQAPH-RZOXKKKKSA-N
2
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

1067.2
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C51H70N16O10
MW 1067.22

Activity Summary

Ki 2 meas. best 10.19
EC50 1 meas. best 10.8

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Melanocyte-stimulating hormone receptor
CHEMBL3795
EC50 10.8 10.8 0.0 1
Melanocyte-stimulating hormone receptor
CHEMBL3795
Ki 10.19 10.19 0.1 1
Melanocortin receptor 4
CHEMBL259
Ki 6.07 6.07 860.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine