cyclo[Ala-Cys(1)-His-D-Phe-Arg-Trp-Ala-Cys(1)-Thr-His-D-Phe-N(Me)Arg-Trp-Pro]

InChIKey	`HJMAXNXTRYYRCZ-QPVXHZIJSA-N`
Compound Name	cyclo[Ala-Cys(1)-His-D-Phe-Arg-Trp-Ala-Cys(1)-Thr-His-D-Phe-N(Me)Arg-Trp-Pro]
Canonical SMILES	`C[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N2`
Clinical Status	Data-mined Candidate
Targets (Human+Pathogen)	4
Pfam Stratification	Homologous
Avg pChEMBL	7.26
Source	ChEMBL;BindingDB

2D Structure

Activity Profile

Target	Gene	Organism	Category	Pfam	pChEMBL	Type	Source
Q01726	MC1R	Homo sapiens	Human	PF00001	8.1	Ki	ChEMBL;BindingDB
P32245	MC4R	Homo sapiens	Human	PF00001	7.8	Ki	ChEMBL;BindingDB
P41968	MC3R	Homo sapiens	Human	PF00001	6.9	Ki	ChEMBL;BindingDB
P33032	MC5R	Homo sapiens	Human	PF00001	6.3	IC50	ChEMBL;BindingDB