SCHEMBL31016492

SCHEMBL31016492

C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](N)Cc1cccnc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 3/20 0.54
▸ OPRM1 P35372 2/20 0.54
▸ CCKBR P32239 10/20 0.53
▸ CCKAR P32238 1/20 0.53
▸ MMP2 P08253 1/20 0.49
▸ MMP9 P14780 1/20 0.49
▸ MMP8 P22894 1/20 0.49
▸ IL23R Q5VWK5 2/20 0.48
▸ GRPR P30550 2/20 0.48
▸ GHSR Q92847 2/20 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
SCHEMBL31016479 0.96 OPRM1 (0.54) OPRD1OPRM1CCKBRCCKARGRPR
SCHEMBL31016475 0.92 CTSL (0.54) OPRD1CCKBRCCKARIL23R
SCHEMBL31016476 0.89 CXCR4 (0.57) IL23R
SCHEMBL31016478 0.89 CXCR4 (0.57) IL23R
SCHEMBL31016496 0.88 OPRD1 (0.55) OPRD1OPRM1CCKBRCCKARMMP2
SCHEMBL31016488 0.84 ACE (0.51) OPRD1CCKBRCCKARMMP2MMP9
SCHEMBL31016481 0.84 CTSL (0.56) OPRD1OPRM1CCKBRGRPR
SCHEMBL31090157 0.83 PRMT1 (0.48) OPRD1OPRM1CCKBRCCKARMMP2
SCHEMBL31016495 0.82 CCKBR (0.57) OPRD1CCKBRCCKARMMP2MMP8
SCHEMBL31571737 0.82 GHSR (0.59) OPRD1OPRM1GHSR

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-118402973-A Application of Qiya seed peptide and derivatives thereof in cosmetics 上海湃肽生物科技有限公司 2024-07-30 — — CN disclosed
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