SCHEMBL30566239

SCHEMBL30566239

CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 16/20 0.44
CTSD P07339 5/20 0.44
BACE2 Q9Y5Z0 2/20 0.41
NPY4R P50391 4/20 0.41
NPY1R P25929 3/20 0.41
NPY2R P49146 2/20 0.41
NPY5R Q15761 2/20 0.41

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
SCHEMBL30140914 0.90 BACE1 (0.48) BACE1CTSDBACE2NPY4RNPY1R
SCHEMBL30812336 0.90 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5R
SCHEMBL31114068 0.90 BACE1 (0.47) BACE1CTSDBACE2NPY4RNPY1R
SCHEMBL30525297 0.90 NPY4R (0.43) BACE1CTSDNPY4RNPY1RNPY2R
SCHEMBL30912352 0.89 IL23R (0.45) BACE1CTSDNPY4RNPY1RNPY2R
SCHEMBL30484832 0.88 FNTA (0.42) NPY4RNPY1RNPY2RNPY5R
SCHEMBL29473683 0.88 TFPI (0.43) NPY4RNPY1RNPY2RNPY5R
SCHEMBL29911841 0.88 BACE1 (0.45) BACE1CTSDBACE2NPY4RNPY1R
SCHEMBL30272511 0.88 NPY4R (0.43) BACE1CTSDNPY4RNPY1RNPY2R
SCHEMBL29524799 0.87 BACE1 (0.42) BACE1CTSDNPY4RNPY1RNPY2R

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-114044809-B Antioxidant active peptide derived from ganoderma lucidum and application thereof 中南林业科技大学 2023-10-20 CN disclosed