SCHEMBL29655740

SCHEMBL29655740

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

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.51
MAPK9 P45984 1/20 0.51
MAPK10 P53779 1/20 0.51
RAMP3 O60896 14/20 0.48
CALCR P30988 14/20 0.48
CALCRL Q16602 2/20 0.44
EPHA2 P29317 1/20 0.44
APLNR P35414 1/20 0.44

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
SCHEMBL30320583 0.89 RAMP3 (0.52) RAMP3CALCREPHA2
SCHEMBL30799203 0.88 MAPK8 (0.49) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL31433207 0.87 APLNR (0.53) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL29460681 0.86 MAPK8 (0.55) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL31313242 0.86 EPHA2 (0.52) RAMP3CALCRCALCRLEPHA2
SCHEMBL31307270 0.86 RAMP3 (0.54) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL31433290 0.85 MAPK8 (0.54) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL29462925 0.85 GRB2 (0.52) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL31433313 0.85 MAPK8 (0.55) MAPK8MAPK9MAPK10RAMP3CALCR
SCHEMBL31419809 0.84 NMUR2 (0.44) MAPK8MAPK9MAPK10RAMP3CALCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114617911-B Glutamyl of peanut meal substrate and its use in flavoring and uric acid reduction 仲恺农业工程学院 2023-08-04 CN disclosed
CN-114617911-A Glutamylation of peanut meal zymolyte and application thereof in flavor development and uric acid reduction 仲恺农业工程学院 2022-06-14 CN disclosed