Molecule Details
InChIKeyUAHFGYDRQSXQEB-LEBBXHLNSA-N
Compound NameScenesse
Canonical SMILESCCCC[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](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=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(N)=O)C(C)C
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)5
Pfam Stratification Cross-Family
Avg pChEMBL8.84
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB04931
Drug NameAfamelanotide
CAS Number75921-69-6
Groups approved investigational
ATC Codes D02BB02
DescriptionAfamelanotide is a first-in-class, synthetic, 13-amino acid peptide analogue of the endogenous alpha melanocyte-stimulating hormone (α-MSH).[L9086] It differs structurally from its endogenous counterpart by only two amino acids - these structural differences improve biological efficacy by imparting ...

Categories: Amino Acids, Peptides, and Proteins Compounds used in a research, industrial, or household setting Dermatologicals Hormones, Hormone Substitutes, and Hormone Antagonists Indicators and Reagents Laboratory Chemicals Melanocortin 1 Receptor (MC1-R) Agonists Melanocortin Receptor Agonists Melanocyte-Stimulating Hormones Peptides Protective Agents Protectives Against UV-Radiation Protectives Against UV-Radiation for Systemic Use Proteins
Cross-references: BindingDB: 82411 ChEBI: 136034 CHEMBL441738 ChemSpider: 17310725 PubChem:16197727 PubChem:175426907 RxCUI: 2262250 Wikipedia: Melanotan
Target Activities (5)
Target Gene Organism Category Pfam pChEMBL Type Source
Q01726 MC1R Homo sapiens Human PF00001 9.3 Ki ChEMBL;BindingDB
P32245 MC4R Homo sapiens Human PF00001 9.1 IC50 ChEMBL;BindingDB
P33032 MC5R Homo sapiens Human PF00001 9.1 IC50 ChEMBL;BindingDB
P41968 MC3R Homo sapiens Human PF00001 8.9 IC50 ChEMBL;BindingDB
P00813 ADA Homo sapiens Human PF00962 7.8 Ki ChEMBL
DrugBank Target Actions (2)
Target Gene Target Name Action Type
Q01726 MC1R Melanocyte-stimulating hormone receptor agonist targets
P32245 MC4R Melanocortin receptor 4 inhibitor targets