SCHEMBL31198207

SCHEMBL31198207

C[C@@H](O)[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 9/20 0.46
▸ NPY1R P25929 5/20 0.46
▸ NPY2R P49146 4/20 0.46
▸ NPY5R Q15761 4/20 0.46
▸ GNAI3 P08754 1/20 0.42
▸ GNAO1 P09471 1/20 0.42
▸ GNAI1 P63096 1/20 0.42
▸ CPB2 Q96IY4 2/20 0.40
▸ FURIN P09958 1/20 0.39
▸ NOD1 Q9Y239 1/20 0.39

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
SCHEMBL18350238 0.98 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5RGNAI3
SCHEMBL29536365 0.98 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5RGNAI3
SCHEMBL29506967 0.98 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5RGNAI3
SCHEMBL30466504 0.95 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL31643184 0.94 NPY4R (0.54) NPY4RNPY1RNPY2RNPY5R
SCHEMBL31276973 0.94 FURIN (0.46) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL4537978 0.94 FURIN (0.46) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL4537958 0.94 FURIN (0.46) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL29850907 0.94 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5RGNAI3
SCHEMBL29484773 0.93 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5R

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-118813574-A Application of directional mutation glycosyltransferase in synthesis of galactoside anthocyanin 浙江大学 2024-10-22 — — CN disclosed
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