SCHEMBL29786697

SCHEMBL29786697

CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)N)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.58
▸ MAPK9 P45984 1/20 0.58
▸ MAPK10 P53779 1/20 0.58
▸ EPHA2 P29317 2/20 0.57
▸ NTSR2 O95665 7/20 0.55
▸ NTSR1 P30989 7/20 0.55
▸ SORT1 Q99523 6/20 0.55
▸ F2 P00734 1/20 0.54
▸ NPY1R P25929 4/20 0.53
▸ NPY2R P49146 4/20 0.53
▸ NPY4R P50391 4/20 0.53
▸ NPY5R Q15761 4/20 0.53
▸ AGTR1 P30556 1/20 0.52
▸ AGTR2 P50052 1/20 0.52

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
SCHEMBL29786714 0.88 MAPK8 (0.53) MAPK8MAPK9MAPK10EPHA2NTSR2
SCHEMBL30607166 0.88 NTSR1 (0.62) NTSR2NTSR1SORT1
SCHEMBL30883237 0.87 NPY2R (0.63) MAPK8MAPK9MAPK10F2NPY1R
SCHEMBL29786708 0.87 MAPK8 (0.54) MAPK8MAPK9MAPK10EPHA2NTSR2
SCHEMBL31657713 0.86 NTSR2 (0.62) MAPK8MAPK9MAPK10NTSR2NTSR1
SCHEMBL30870095 0.86 MAPK8 (0.59) MAPK8MAPK9MAPK10NTSR2NTSR1
SCHEMBL30361699 0.86 NTSR1 (0.59) MAPK8MAPK9MAPK10EPHA2NTSR2
SCHEMBL30826816 0.86 MAPK8 (0.65) MAPK8MAPK9MAPK10EPHA2NPY1R
SCHEMBL29396082 0.85 RAMP3 (0.64) EPHA2NPY1RNPY2RNPY4RNPY5R
SCHEMBL30038638 0.85 NPY1R (0.69) MAPK8MAPK9MAPK10NTSR2NTSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114763370-B Antioxidant decapeptide and preparation method and application thereof 中国科学院华南植物园 2023-06-27 — — CN claimed
CN-114763370-A Antioxidant decapeptide and preparation method and application thereof 中国科学院华南植物园 2022-07-19 — — CN claimed
CN-114763370-B Antioxidant decapeptide and preparation method and application thereof 中国科学院华南植物园 2023-06-27 — — CN disclosed
CN-114763370-B Antioxidant decapeptide and preparation method and application thereof 中国科学院华南植物园 2023-06-27 — — CN disclosed
CN-114763370-A Antioxidant decapeptide and preparation method and application thereof 中国科学院华南植物园 2022-07-19 — — CN disclosed
CN-114763370-A Antioxidant decapeptide and preparation method and application thereof 中国科学院华南植物园 2022-07-19 — — CN disclosed
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