SCHEMBL31427600

SCHEMBL31427600

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 11/20 0.53
▸ OPRM1 P35372 7/20 0.52
▸ OPRK1 P41145 2/20 0.51
▸ TFPI P10646 1/20 0.49

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
SCHEMBL31614421 0.89 OPRD1 (0.57) OPRD1OPRM1OPRK1
SCHEMBL31614432 0.88 OPRD1 (0.56) OPRD1OPRM1OPRK1
SCHEMBL29591874 0.88 NPY1R (0.55) OPRD1OPRM1OPRK1
SCHEMBL29649718 0.87 OPRD1 (0.60) OPRD1OPRM1OPRK1
SCHEMBL29376413 0.86 TFPI (0.56) OPRD1OPRM1OPRK1TFPI
SCHEMBL31614425 0.86 OPRD1 (0.56) OPRD1OPRM1OPRK1
SCHEMBL30317543 0.85 NPY4R (0.60) OPRD1OPRM1
SCHEMBL29590452 0.85 OPRM1 (0.55) OPRD1OPRM1OPRK1TFPI
SCHEMBL30898605 0.85 OPRD1 (0.62) OPRD1OPRM1OPRK1
SCHEMBL31257059 0.85 OPRD1 (0.61) OPRD1OPRM1OPRK1

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-118307633-B Antarctic krill ACE (angiotensin converting enzyme) inhibitory peptide LGGIF, YLGGAL, LGGLNQ and application thereof 中国水产科学研究院黄海水产研究所 2025-02-18 — — CN claimed
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