SCHEMBL30426633

SCHEMBL30426633

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

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 7/20 0.35
▸ OPRM1 P35372 6/20 0.35
▸ OPRK1 P41145 2/20 0.35
▸ MME P08473 3/20 0.34
▸ KISS1R Q969F8 2/20 0.34
▸ GHSR Q92847 2/20 0.34
▸ BACE1 P56817 2/20 0.33
▸ PSMB1 P20618 1/20 0.33
▸ PSMB9 P28065 1/20 0.33
▸ PSMB5 P28074 1/20 0.33
▸ PSMB10 P40306 1/20 0.33
▸ PSMB2 P49721 1/20 0.33

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
SCHEMBL30781148 0.96 MME (0.37) OPRD1OPRM1OPRK1MMEPSMB1
SCHEMBL29630654 0.94 OPRD1 (0.37) OPRD1OPRM1OPRK1GHSRBACE1
SCHEMBL30607295 0.93 OPRD1 (0.37) OPRD1OPRM1OPRK1KISS1RBACE1
SCHEMBL38661411 0.92 MME (0.39) MMEBACE1
SCHEMBL30253800 0.92 MME (0.39) MMEBACE1
SCHEMBL30449517 0.92 MME (0.40) OPRD1OPRM1OPRK1MMEKISS1R
SCHEMBL31113501 0.92 BACE1 (0.35) OPRD1OPRM1OPRK1GHSRBACE1
SCHEMBL29630414 0.91 OPRD1 (0.36) OPRD1OPRM1OPRK1MMEGHSR
SCHEMBL29590996 0.91 OPRD1 (0.36) OPRD1OPRM1OPRK1MMEGHSR
SCHEMBL29973895 0.91 PSMB1 (0.35) OPRD1OPRM1OPRK1BACE1PSMB1

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-116178491-A Pearl peptide with whitening and antioxidation effects, and preparation method and application thereof 广东海洋大学 2023-05-30 — — CN claimed
CN-116178491-A Pearl peptide with whitening and antioxidation effects, and preparation method and application thereof 广东海洋大学 2023-05-30 — — CN disclosed
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