SCHEMBL31362692

SCHEMBL31362692

N=C(N)NCCC[C@H](N)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 7/20 0.49
▸ ACE2 Q9BYF1 4/20 0.49
▸ OPRM1 P35372 4/20 0.48
▸ OPRD1 P41143 3/20 0.48
▸ OPRK1 P41145 1/20 0.47

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
SCHEMBL31165891 0.90 NRP1 (0.41) OPRM1OPRK1
SCHEMBL31091335 0.90 ACE (0.50) ACEACE2
SCHEMBL31362700 0.90 NTSR2 (0.51) OPRM1OPRD1
SCHEMBL29569993 0.89 OPRM1 (0.53) OPRM1OPRD1OPRK1
SCHEMBL29727282 0.87 NTSR2 (0.52) OPRD1
SCHEMBL29610294 0.86 OPRM1 (0.54) OPRM1OPRD1OPRK1
SCHEMBL31362676 0.86 CALCRL (0.51) ACEOPRM1OPRD1OPRK1
SCHEMBL30739385 0.85 OPRM1 (0.54) OPRM1OPRD1OPRK1
SCHEMBL31206155 0.85 OPRM1 (0.54) OPRM1OPRD1OPRK1
SCHEMBL31467755 0.85 OPRM1 (0.53) OPRM1OPRD1OPRK1

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-119390815-A Whey protein peptide, whey protein fermentation concentrate, and preparation method and application thereof 张少辉 2025-02-07 — — CN disclosed
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