SCHEMBL31006409

SCHEMBL31006409

N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 1/20 0.47
▸ OPRM1 P35372 2/20 0.47
▸ OPRD1 P41143 4/20 0.47
▸ NPY1R P25929 1/20 0.46
▸ NPY2R P49146 1/20 0.46
▸ NPY4R P50391 1/20 0.46
▸ YARS1 P54577 2/20 0.45
▸ ACE P12821 1/20 0.45
▸ SLC7A5 Q01650 1/20 0.45

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
SCHEMBL38650869 1.00 MME (0.47) MMEOPRM1OPRD1NPY1RNPY2R
SCHEMBL31259944 1.00 MME (0.47) MMEOPRM1OPRD1NPY1RNPY2R
SCHEMBL31553196 0.99 YARS1 (0.46) MMEOPRM1OPRD1NPY1RNPY2R
SCHEMBL30629018 0.98 MME (0.47) MMEOPRM1OPRD1NPY1RNPY2R
SCHEMBL23598458 0.97 SLC7A5 (0.48) MMEOPRM1OPRD1YARS1ACE
SCHEMBL4434130 0.97 SLC7A5 (0.48) MMEOPRM1OPRD1YARS1ACE
SCHEMBL9664998 0.97 SLC7A5 (0.48) MMEOPRM1OPRD1YARS1ACE
SCHEMBL9665005 0.97 SLC7A5 (0.48) MMEOPRM1OPRD1YARS1ACE
SCHEMBL4434143 0.97 SLC7A5 (0.48) MMEOPRM1OPRD1YARS1ACE
SCHEMBL31256968 0.96 OPRD1 (0.46) MMEOPRM1OPRD1NPY1RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118165072-A Maotai-flavor liquor endogenous oligopeptide and application thereof 邵阳学院 2024-06-11 — — CN claimed
CN-118165072-A Maotai-flavor liquor endogenous oligopeptide and application thereof 邵阳学院 2024-06-11 — — CN disclosed
CN-118165072-A Maotai-flavor liquor endogenous oligopeptide and application thereof 邵阳学院 2024-06-11 — — CN disclosed
Send feedback