Brief Information of the Compound and Protein
Compound Name
 Compound Info 
CAS_75921-69-6
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 PubChem ID
CID: 91898441
SID: 16544557
Canonical SMILES
CCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(N)=O
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Compound Formula C78H111N21O19
Compound Structure
Protein Name
 Protein Info 
Melanocyte-stimulating hormone receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
>
Short peptide receptor (family A GPCR)
>
Melanocortin receptor
Uniprot ID
Q01727
Gene Name
MC1R
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  17
1
EC50 = 0.01 nM
   TI
   LI
   LO
   TS
2
EC50 = 0.012 nM
   TI
   LI
   LO
   TS
3
EC50 = 0.015 nM
   TI
   LI
   LO
   TS
4
EC50 = 0.018 nM
   TI
   LI
   LO
   TS
5
EC50 = 0.02 nM
   TI
   LI
   LO
   TS
6
EC50 = 0.021 nM
   TI
   LI
   LO
   TS
7
EC50 = 0.023 nM
   TI
   LI
   LO
   TS
8
EC50 = 0.03 nM
   TI
   LI
   LO
   TS
9
EC50 = 0.038 nM
   TI
   LI
   LO
   TS
10
EC50 = 0.04 nM
   TI
   LI
   LO
   TS
11
EC50 = 0.05 nM
   TI
   LI
   LO
   TS
12
EC50 = 0.051 nM
   TI
   LI
   LO
   TS
13
EC50 = 0.088 nM
   TI
   LI
   LO
   TS
14
EC50 = 0.09 nM
   TI
   LI
   LO
   TS
15
EC50 = 0.092 nM
   TI
   LI
   LO
   TS
16
IC50 = 0.29 nM
   TI
   LI
   LO
   TS
17
IC50 = 0.31 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 EC50 = 0.018 nM
2 EC50 = 0.038 nM