SCHEMBL30609013

SCHEMBL30609013

C[C@@H](O)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 12/20 0.42
▸ NPY1R P25929 8/20 0.42
▸ NPY2R P49146 6/20 0.42
▸ NPY5R Q15761 6/20 0.42
▸ SLC15A2 Q16348 1/20 0.41
▸ C5AR1 P21730 1/20 0.40
▸ APLNR P35414 2/20 0.39
▸ TUBB4A P04350 1/20 0.39
▸ TUBB P07437 1/20 0.39
▸ TUBA3C P0DPH7 1/20 0.39
▸ TUBA1B P68363 1/20 0.39
▸ TUBA4A P68366 1/20 0.39
▸ TUBB4B P68371 1/20 0.39
▸ TUBB3 Q13509 1/20 0.39
▸ TUBB2A Q13885 1/20 0.39
▸ TUBB8 Q3ZCM7 1/20 0.39
▸ TUBA3E Q6PEY2 1/20 0.39
▸ TUBA1A Q71U36 1/20 0.39
▸ TUBA1C Q9BQE3 1/20 0.39
▸ TUBB6 Q9BUF5 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
SCHEMBL30974012 0.95 NPY4R (0.42) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL31547783 0.93 NPY4R (0.42) NPY4RNPY1RNPY2RNPY5RAPLNR
SCHEMBL29482616 0.92 NPY4R (0.41) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL30525411 0.91 NPY4R (0.44) NPY4RNPY1RNPY2RNPY5RSLC15A2
SCHEMBL29653774 0.91 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RSLC15A2
SCHEMBL29754443 0.91 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RSLC15A2
SCHEMBL31315020 0.91 SLC15A2 (0.43) NPY4RNPY1RNPY2RNPY5RSLC15A2
SCHEMBL30947692 0.91 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RSLC15A2
SCHEMBL29653698 0.91 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RSLC15A2
SCHEMBL29754546 0.91 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RSLC15A2

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
WO-2023169550-A1 POLYPEPTIDE COMPOUND FOR PREVENTING AND/OR TREATING RENAL FIBROSIS 中山大学 2023-09-14 — — WO disclosed
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