SCHEMBL30528331

SCHEMBL30528331

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

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 5/20 0.54
▸ OPRK1 P41145 4/20 0.53
▸ ACE P12821 1/20 0.53
▸ REN P00797 1/20 0.52
▸ OPRM1 P35372 4/20 0.52
▸ NMUR2 Q9GZQ4 1/20 0.51
▸ NMUR1 Q9HB89 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
SCHEMBL30586607 0.91 OPRD1 (0.54) OPRD1OPRM1
SCHEMBL30586584 0.88 OPRD1 (0.59) OPRD1OPRK1RENOPRM1
SCHEMBL29679971 0.86 OPRD1 (0.60) OPRD1OPRK1OPRM1NMUR2
SCHEMBL31040682 0.85 OPRD1 (0.58) OPRD1OPRK1OPRM1
SCHEMBL29679540 0.85 OPRD1 (0.57) OPRD1OPRK1OPRM1NMUR2NMUR1
SCHEMBL29367698 0.85 NPY2R (0.60) OPRK1OPRM1NMUR2NMUR1
SCHEMBL29679769 0.85 OPRD1 (0.56) OPRD1OPRM1
SCHEMBL29680203 0.84 KDM1A (0.56) OPRK1
SCHEMBL29666135 0.83 OPRK1 (0.58) OPRD1OPRK1RENOPRM1
SCHEMBL31433218 0.83 OPRD1 (0.57) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116444649-A Milk active peptide GITDPLFKGM, GITDPLFKG and its obtaining method and use 内蒙古伊利实业集团股份有限公司 2023-07-18 — — CN claimed
CN-116444611-B Milk active peptide TDPLFKG and preparation method and application thereof 内蒙古伊利实业集团股份有限公司 2024-06-04 — — CN disclosed
CN-116444649-B Milk active peptide GITDPLFKGM, GITDPLFKG and its obtaining method and use 内蒙古伊利实业集团股份有限公司 2024-05-24 — — CN disclosed
CN-116444649-B Milk active peptide GITDPLFKGM, GITDPLFKG and its obtaining method and use 内蒙古伊利实业集团股份有限公司 2024-05-24 — — CN disclosed
CN-116444649-A Milk active peptide GITDPLFKGM, GITDPLFKG and its obtaining method and use 内蒙古伊利实业集团股份有限公司 2023-07-18 — — CN disclosed
CN-116444649-A Milk active peptide GITDPLFKGM, GITDPLFKG and its obtaining method and use 内蒙古伊利实业集团股份有限公司 2023-07-18 — — CN disclosed
CN-116444611-A Milk active peptide TDPLFKG, 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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