SCHEMBL31064825

SCHEMBL31064825

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

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 13/20 0.43
▸ NPY5R Q15761 9/20 0.43
▸ NPY1R P25929 8/20 0.43
▸ NPY2R P49146 6/20 0.43
▸ TFPI P10646 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.37
▸ NMT2 O60551 1/20 0.37
▸ NMT1 P30419 1/20 0.37
▸ NOD1 Q9Y239 1/20 0.36

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
SCHEMBL30435145 0.93 NPY4R (0.43) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL29482452 0.89 NPY4R (0.43) NPY4RNPY5RNPY1RNPY2RNOD1
SCHEMBL30120973 0.89 NPY4R (0.43) NPY4RNPY5RNPY1RNPY2RNOD1
SCHEMBL30471796 0.87 NPY4R (0.52) NPY4RNPY5RNPY1RNPY2R
SCHEMBL29870912 0.87 TFPI (0.48) NPY4RNPY5RNPY1RNPY2RTFPI
SCHEMBL30883199 0.87 TFPI (0.40) NPY4RNPY5RNPY1RNPY2RTFPI
SCHEMBL30930537 0.85 TFPI (0.47) NPY4RNPY5RNPY1RNPY2RTFPI
SCHEMBL31589634 0.85 NPY4R (0.48) NPY4RNPY5RNPY1RNPY2RNOD1
SCHEMBL29476644 0.85 NPY4R (0.48) NPY4RNPY5RNPY1RNPY2RNOD1
SCHEMBL29476392 0.85 NPY4R (0.48) NPY4RNPY5RNPY1RNPY2RNOD1

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-118581102-A Corn aspergillus flavus resistance gene ZmAFR, expression product, excellent haplotype and application thereof in corn breeding 河南农业大学 2024-09-03 — — CN disclosed
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