Sugi Predict

Sugi Predict / Compounds / SCHEMBL30733332

SCHEMBL30733332

SCHEMBL30733332

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

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NTSR2 O95665 3/20 0.52
▸ NTSR1 P30989 3/20 0.52
▸ RAMP3 O60896 6/20 0.49
▸ CALCR P30988 6/20 0.49
▸ OPRD1 P41143 5/20 0.48
▸ OPRM1 P35372 1/20 0.48
▸ CXCR4 P61073 1/20 0.48

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
SCHEMBL31433200 0.90 RAMP3 (0.51) NTSR2NTSR1RAMP3CALCROPRD1
SCHEMBL30733270 0.90 RAMP3 (0.52) RAMP3CALCR
SCHEMBL30099425 0.89 KEAP1 (0.51) RAMP3CALCROPRD1OPRM1
SCHEMBL29479866 0.89 NPY2R (0.51) RAMP3CALCROPRD1
SCHEMBL30431793 0.89 NPY2R (0.52) RAMP3CALCRCXCR4
SCHEMBL29736175 0.88 RAMP3 (0.58) RAMP3CALCRCXCR4
SCHEMBL30512664 0.88 OPRD1 (0.62) NTSR1OPRD1OPRM1
SCHEMBL1690986 0.87 NTSR1 (0.54) NTSR2NTSR1OPRD1OPRM1CXCR4
SCHEMBL1690987 0.87 NTSR1 (0.54) NTSR2NTSR1OPRD1OPRM1CXCR4
SCHEMBL30969027 0.87 KEAP1 (0.50) NTSR2NTSR1RAMP3CALCROPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117624297-A Seafood mushroom flavor peptide and extraction method and application thereof 陕西科技大学 2024-03-01 — — CN disclosed
CN-117486972-A Sea fresh mushroom salty peptide and extraction method and application thereof 陕西科技大学 2024-02-02 — — CN disclosed
CN-117486972-A Sea fresh mushroom salty peptide and extraction method and application thereof 陕西科技大学 2024-02-02 — — CN disclosed
Send feedback