cyclo[Arg-Cys(1)-His-Phe-Arg-Trp-Arg-Cys(1)-Nle-Gly-His-Phe-Arg-Trp-Asp]

InChIKey	`DZOXHHUQYQUKJB-KHKKPXNASA-N`
Compound Name	cyclo[Arg-Cys(1)-His-Phe-Arg-Trp-Arg-Cys(1)-Nle-Gly-His-Phe-Arg-Trp-Asp]
Canonical SMILES	`CCCC[C@@H]1NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](Cc3cnc[nH]3)NC(=O)CNC1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N2`
Clinical Status	Data-mined Candidate
Targets (Human+Pathogen)	4
Pfam Stratification	Homologous
Avg pChEMBL	7.67
Source	ChEMBL;BindingDB

2D Structure

Activity Profile

Target	Gene	Organism	Category	Pfam	pChEMBL	Type	Source
Q01726	MC1R	Homo sapiens	Human	PF00001	8.5	Ki	ChEMBL;BindingDB
P41968	MC3R	Homo sapiens	Human	PF00001	7.7	Ki	ChEMBL;BindingDB
P33032	MC5R	Homo sapiens	Human	PF00001	7.4	IC50	ChEMBL;BindingDB
P32245	MC4R	Homo sapiens	Human	PF00001	7.1	Ki	ChEMBL;BindingDB