SCHEMBL29575402

SCHEMBL29575402

CC(C)C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 10/20 0.54
▸ NPY1R P25929 7/20 0.54
▸ NPY2R P49146 5/20 0.54
▸ NPY5R Q15761 5/20 0.54
▸ EPHA2 P29317 2/20 0.53
▸ NMUR2 Q9GZQ4 3/20 0.52
▸ NMUR1 Q9HB89 3/20 0.52
▸ KDM1A O60341 1/20 0.51
▸ RAMP3 O60896 1/20 0.51
▸ CALCR P30988 1/20 0.51
▸ MC4R P32245 1/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ OPRD1 P41143 1/20 0.51

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
SCHEMBL30293724 0.87 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5REPHA2
SCHEMBL29554996 0.86 NMUR2 (0.65) EPHA2NMUR2NMUR1KDM1ARAMP3
SCHEMBL31307252 0.85 EPHA2 (0.63) NPY4RNPY1RNPY2RNPY5REPHA2
SCHEMBL30389216 0.85 EPHA2 (0.60) NPY4RNPY1RNPY2RNPY5REPHA2
SCHEMBL5163482 0.85 NMUR2 (0.60) NPY4RNPY1RNPY2RNPY5RNMUR2
SCHEMBL3863996 0.84 NMUR2 (0.56) EPHA2NMUR2NMUR1KDM1AOPRM1
SCHEMBL3864010 0.84 NMUR2 (0.56) EPHA2NMUR2NMUR1KDM1AOPRM1
SCHEMBL30823890 0.84 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5REPHA2
SCHEMBL30689267 0.84 OPRK1 (0.59) NPY4RNPY1RNPY2RNPY5RNMUR2
SCHEMBL29666821 0.84 OPRM1 (0.56) EPHA2NMUR2NMUR1OPRM1OPRD1

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-113278049-B Selenium-rich flavor peptide separated from selenium-rich seaweed, preparation method and application 国民康健(北京)自然科学研究有限公司 2022-04-29 — — CN disclosed
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