SCHEMBL29557496

SCHEMBL29557496

CC(C)C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 6/20 0.38
▸ MME P08473 3/20 0.38
▸ OPRM1 P35372 1/20 0.36
▸ OPRD1 P41143 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ CTSD P07339 1/20 0.35
▸ PTPN1 P18031 1/20 0.35

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
SCHEMBL29367112 0.91 NPY1R (0.40) MME
SCHEMBL29367110 0.91 NPY1R (0.40) MME
SCHEMBL28183041 0.91 ECE1 (0.40) MME
SCHEMBL10583276 0.91 ECE1 (0.40) MME
SCHEMBL30781191 0.91 ECE1 (0.40) MME
SCHEMBL30781109 0.91 ECE1 (0.40) MME
SCHEMBL10583281 0.91 ECE1 (0.40) MME
SCHEMBL29590592 0.90 BACE1 (0.39) BACE1OPRD1CTSDPTPN1
SCHEMBL30449517 0.90 MME (0.40) BACE1MMEOPRM1OPRD1OPRK1
SCHEMBL30426633 0.90 OPRD1 (0.35) BACE1MMEOPRM1OPRD1OPRK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114057837-B Antioxidant peptide with liver protection function separated from mytilus coruscus meat, and preparation method and application thereof 浙江海洋大学 2024-01-26 — — CN disclosed
CN-114057837-A A group of antioxidant peptides separated from Mytilus coruscus meat and having liver protecting function, and its preparation method and application 浙江海洋大学 2022-02-18 — — CN disclosed
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