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Sugi Predict / Compounds / SCHEMBL31016481

SCHEMBL31016481

SCHEMBL31016481

CC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 3/20 0.56
▸ CTSS P25774 3/20 0.56
▸ CTSK P43235 3/20 0.56
▸ CTSH P09668 1/20 0.56
▸ CCKBR P32239 12/20 0.53
▸ GRPR P30550 2/20 0.52
▸ OPRM1 P35372 1/20 0.51
▸ OPRD1 P41143 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
SCHEMBL31016496 0.94 OPRD1 (0.55) CTSLCTSSCTSKCTSHCCKBR
SCHEMBL18556752 0.91 CTSL (0.52) CTSLCTSSCTSKCTSHCCKBR
SCHEMBL31016483 0.90 CCKBR (0.57) CTSLCTSSCTSKCCKBRGRPR
SCHEMBL31016477 0.89 MMP2 (0.60) CTSLCTSSCTSKCTSHCCKBR
SCHEMBL31016479 0.88 OPRM1 (0.54) CCKBRGRPROPRM1OPRD1
SCHEMBL31016480 0.88 CTSL (0.63) CTSLCTSSCTSKCTSHCCKBR
SCHEMBL18556704 0.87 OPRM1 (0.49) CTSLCTSSCTSKCTSHGRPR
SCHEMBL18556712 0.87 KISS1R (0.55) CTSLCTSSCTSKCCKBRGRPR
SCHEMBL31016488 0.86 ACE (0.51) CCKBROPRD1
SCHEMBL31016493 0.86 CTSL (0.60) CTSLCTSSCTSKCTSH

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-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 claimed
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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