SCHEMBL30498968

SCHEMBL30498968

C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.60
▸ OPRM1 P35372 4/20 0.56
▸ ACE P12821 2/20 0.53
▸ OPRD1 P41143 3/20 0.53
▸ CALCRL Q16602 1/20 0.52
▸ EPHA2 P29317 2/20 0.51
▸ SLC6A2 P23975 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
SCHEMBL29824884 0.90 F2 (0.55) F2OPRM1ACEOPRD1
SCHEMBL13697492 0.89 CALCRL (0.56) F2OPRM1ACEOPRD1CALCRL
SCHEMBL30494482 0.89 F2 (0.57) F2OPRM1ACEOPRD1CALCRL
SCHEMBL30658583 0.89 F2 (0.58) F2OPRM1ACEOPRD1CALCRL
SCHEMBL30197420 0.88 F2 (0.60) F2OPRM1ACEOPRD1SLC6A2
SCHEMBL30658558 0.88 F2 (0.56) F2OPRM1ACEOPRD1CALCRL
SCHEMBL30512720 0.86 APLNR (0.53) F2OPRM1OPRD1
SCHEMBL29679700 0.86 CXCR4 (0.53) F2OPRM1OPRD1
SCHEMBL30242217 0.86 CALCRL (0.57) F2OPRM1OPRD1CALCRLSLC6A2
SCHEMBL31510132 0.85 F2 (0.60) F2OPRM1ACEOPRD1SLC6A2

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-116444608-B Milk active peptide DPSFFAKE and preparation method and application thereof 内蒙古伊利实业集团股份有限公司 2024-06-25 — — CN disclosed
CN-116444608-A Milk active peptide DPSFFAKE and preparation method and application thereof 内蒙古伊利实业集团股份有限公司 2023-07-18 — — CN disclosed
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