SCHEMBL30771413

SCHEMBL30771413

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 11/20 0.53
▸ KDM1A O60341 3/20 0.51
▸ MAPK8 P45983 1/20 0.49
▸ MAPK9 P45984 1/20 0.49
▸ MAPK10 P53779 1/20 0.49
▸ MAOB P27338 1/20 0.47
▸ KDM5A P29375 1/20 0.47
▸ KDM1B Q8NB78 1/20 0.47
▸ NTSR1 P30989 2/20 0.43
▸ TACR1 P25103 1/20 0.43
▸ NTSR2 O95665 1/20 0.42

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
SCHEMBL30311126 0.99 REN (0.53) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL30402079 0.99 REN (0.53) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL30400291 0.99 REN (0.53) RENKDM1AMAPK8MAPK9MAPK10
Acetic Acid SCHEMBL30311266 0.98 REN (0.52) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL30311456 0.97 REN (0.53) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL30401671 0.96 KDM1A (0.55) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL30401369 0.96 KDM1A (0.55) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL30311123 0.96 KDM1A (0.55) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL30401786 0.96 KDM1A (0.55) RENKDM1AMAPK8MAPK9MAPK10
SCHEMBL30311476 0.96 KDM1A (0.54) RENKDM1AMAPK8MAPK9MAPK10

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-113880915-B Polypeptide for repairing mucous membrane injury or skin wound and application thereof 四川好医生攀西药业有限责任公司 2024-02-13 — — CN claimed
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