SCHEMBL31265334

SCHEMBL31265334

CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 10/20 0.41
▸ NPY1R P25929 8/20 0.41
▸ NPY5R Q15761 7/20 0.41
▸ NPY2R P49146 4/20 0.38
▸ NOD1 Q9Y239 2/20 0.37
▸ ENPEP Q07075 7/20 0.37

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
SCHEMBL15011349 0.95 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL27732271 0.95 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL9614927 0.95 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL30111320 0.93 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL30463291 0.93 CPB2 (0.42) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30197540 0.93 NPY5R (0.43) NPY4RNPY1RNPY5RNPY2RENPEP
SCHEMBL30730451 0.93 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL30962454 0.90 NPY4R (0.39) NPY4RNPY1RNPY5RNPY2RNOD1
SCHEMBL31318675 0.90 ENPEP (0.47) ENPEP
SCHEMBL19554383 0.90 NPY4R (0.39) NPY4RNPY1RNPY5RNPY2RNOD1

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-118853640-A Carbapenem drug-resistant gene and application thereof 郑州大学 2024-10-29 — — CN disclosed
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