SCHEMBL31154639

SCHEMBL31154639

CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 5/20 0.58
▸ OPRM1 P35372 4/20 0.58
▸ NMUR2 Q9GZQ4 6/20 0.57
▸ NMUR1 Q9HB89 6/20 0.57
▸ APLNR P35414 4/20 0.51
▸ MAPK8 P45983 1/20 0.50
▸ MAPK9 P45984 1/20 0.50
▸ MAPK10 P53779 1/20 0.50
▸ CXCR4 P61073 1/20 0.48
▸ PLK1 P53350 1/20 0.48

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
SCHEMBL29506440 0.90 NMUR2 (0.58) OPRD1OPRM1NMUR2NMUR1MAPK8
SCHEMBL31174607 0.90 NMUR2 (0.50) OPRD1OPRM1NMUR2NMUR1CXCR4
SCHEMBL30678863 0.88 NMUR2 (0.56) OPRD1OPRM1NMUR2NMUR1
SCHEMBL31196708 0.88 APLNR (0.58) OPRD1OPRM1NMUR2NMUR1APLNR
SCHEMBL30997459 0.87 EPHA2 (0.56) OPRD1OPRM1NMUR2NMUR1APLNR
SCHEMBL30842156 0.85 NMUR2 (0.65) OPRD1OPRM1NMUR2NMUR1CXCR4
SCHEMBL30930553 0.85 NMUR2 (0.67) OPRD1OPRM1NMUR2NMUR1CXCR4
SCHEMBL30964513 0.84 RAMP3 (0.64) NMUR2NMUR1APLNRMAPK8MAPK9
SCHEMBL31433412 0.84 APLNR (0.58) OPRD1OPRM1NMUR2NMUR1APLNR
SCHEMBL30629127 0.84 NMUR2 (0.63) OPRD1OPRM1NMUR2NMUR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119039385-A Sturgeon meat antioxidant oligopeptide with vascular endothelial oxidative damage repair function and application thereof 浙江海洋大学 2024-11-29 — — CN disclosed
CN-118812645-A Nibea albiflora swim bladder antioxidant oligopeptide with skin ultraviolet injury repair function and application thereof 浙江海洋大学 2024-10-22 — — CN disclosed
CN-118772236-A Spanish mackerel head oligopeptide with diabetes treatment function and application thereof 浙江海洋大学 2024-10-15 — — CN disclosed
CN-118772236-A Spanish mackerel head oligopeptide with diabetes treatment function and application thereof 浙江海洋大学 2024-10-15 — — CN disclosed
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