SCHEMBL30310199

SCHEMBL30310199

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 4/20 0.55
▸ APLNR P35414 2/20 0.52
▸ OPRD1 P41143 2/20 0.52
▸ F2 P00734 1/20 0.52
▸ OPRM1 P35372 3/20 0.51
▸ REN P00797 2/20 0.51
▸ SLC6A2 P23975 1/20 0.51

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
SCHEMBL31127558 0.91 F2 (0.60) OPRK1OPRD1F2OPRM1SLC6A2
SCHEMBL31127566 0.90 OPRM1 (0.60) OPRD1F2OPRM1SLC6A2
SCHEMBL30723552 0.88 F2 (0.49) APLNRF2OPRM1
SCHEMBL29569038 0.88 NTSR2 (0.61) OPRK1OPRD1OPRM1REN
SCHEMBL6516908 0.87 REN (0.58) OPRK1OPRD1OPRM1RENSLC6A2
SCHEMBL29525618 0.87 REN (0.58) OPRK1OPRD1OPRM1RENSLC6A2
SCHEMBL29568664 0.87 REN (0.62) OPRK1OPRD1OPRM1REN
SCHEMBL38652354 0.87 SLC6A2 (0.55) OPRK1OPRD1OPRM1RENSLC6A2
SCHEMBL29798185 0.87 OPRK1 (0.54) OPRK1OPRM1REN
SCHEMBL29607152 0.87 APLNR (0.55) OPRK1APLNROPRM1

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-115851517-B Strain with potential of producing ACE inhibitory peptide and application thereof 西南民族大学 2024-10-29 — — CN disclosed
CN-115851517-A Strain with potential of producing ACE inhibitory peptide and application thereof 西南民族大学 2023-03-28 — — CN disclosed
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