SCHEMBL29786765

SCHEMBL29786765

CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.56
▸ MAPK9 P45984 1/20 0.56
▸ MAPK10 P53779 1/20 0.56
▸ CALCRL Q16602 1/20 0.43
▸ KEAP1 Q14145 1/20 0.42
▸ REN P00797 7/20 0.41
▸ CTSD P07339 1/20 0.41
▸ BACE1 P56817 1/20 0.41
▸ KDM1A O60341 2/20 0.40
▸ NPY4R P50391 2/20 0.39
▸ VIPR2 P41587 3/20 0.38
▸ VIPR1 P32241 2/20 0.38
▸ BECN1 Q14457 1/20 0.38

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
SCHEMBL29519009 0.89 MAPK8 (0.47) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL30844409 0.87 KDM1A (0.47) MAPK8MAPK9MAPK10CALCRLREN
SCHEMBL30512528 0.87 MAPK8 (0.52) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL30693076 0.87 MAPK8 (0.48) MAPK8MAPK9MAPK10CALCRLKEAP1
SCHEMBL29886731 0.87 MAPK8 (0.41) MAPK8MAPK9MAPK10CALCRLKEAP1
SCHEMBL31410829 0.86 MAPK8 (0.62) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL5580302 0.85 MAPK8 (0.61) MAPK8MAPK9MAPK10KEAP1VIPR2
SCHEMBL5580299 0.85 MAPK8 (0.61) MAPK8MAPK9MAPK10KEAP1VIPR2
SCHEMBL29636365 0.85 MAPK8 (0.43) MAPK8MAPK9MAPK10CALCRLREN
SCHEMBL30185737 0.85 MAPK8 (0.46) MAPK8MAPK9MAPK10KEAP1REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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