SCHEMBL30851358

SCHEMBL30851358

NCCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 6/20 0.63
NPY1R P25929 5/20 0.63
NPY2R P49146 4/20 0.63
ERAP2 Q6P179 1/20 0.56
LNPEP Q9UIQ6 1/20 0.56
NPY5R Q15761 3/20 0.56
NTSR2 O95665 2/20 0.53
NTSR1 P30989 2/20 0.53
ENPEP Q07075 2/20 0.53
MMP2 P08253 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Lysyl-Tyrosyl-Lysine Acetate SCHEMBL6275111 0.99 NPY4R (0.62) NPY4RNPY1RNPY2RERAP2LNPEP
Lysyl-Tyrosyl-Lysine Acetate SCHEMBL6275116 0.99 NPY4R (0.62) NPY4RNPY1RNPY2RERAP2LNPEP
SCHEMBL27942027 0.99 NPY4R (0.62) NPY4RNPY1RNPY2RERAP2LNPEP
SCHEMBL30772332 0.96 NPY4R (0.64) NPY4RNPY1RNPY2RERAP2LNPEP
SCHEMBL29576811 0.95 NPY4R (0.59) NPY4RNPY1RNPY2RERAP2LNPEP
SCHEMBL29577087 0.95 NPY4R (0.59) NPY4RNPY1RNPY2RERAP2LNPEP
Lysyl-Tyrosyl-Lysine Acetate SCHEMBL4291040 0.95 NPY4R (0.61) NPY4RNPY1RNPY2RERAP2LNPEP
SCHEMBL30931517 0.95 LNPEP (0.62) NPY4RNPY1RNPY2RERAP2LNPEP
SCHEMBL30118045 0.95 LNPEP (0.62) NPY4RNPY1RNPY2RERAP2LNPEP
SCHEMBL30179294 0.95 NPY4R (0.63) NPY4RNPY1RNPY2RERAP2LNPEP

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112040968-B Bioactive peptides with high binding affinity to human muscle nicotinic acetylcholine receptors 欧莱雅 2024-01-30 CN disclosed