SCHEMBL9810252

SCHEMBL9810252

N[C@@H](CCCCNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GRIA1 P42261 3/20 0.56
▸ CHRND Q07001 7/20 0.54
▸ CHRNA1 P02708 3/20 0.54
▸ CHRNG P07510 3/20 0.54
▸ CHRNB1 P11230 3/20 0.54
▸ NPY4R P50391 3/20 0.53
▸ NPY1R P25929 2/20 0.53
▸ NPY2R P49146 2/20 0.53
▸ NPY5R Q15761 2/20 0.53
▸ SLC7A5 Q01650 1/20 0.52

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
SCHEMBL10618982 0.88 ERAP2 (0.53) GRIA1NPY4RNPY1RNPY2RNPY5R
SCHEMBL31606492 0.85 NPY4R (0.57) GRIA1NPY4RNPY1RNPY2RNPY5R
SCHEMBL11209766 0.82 LNPEP (0.58) GRIA1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL31606458 0.82 NPY4R (0.67) NPY4RNPY1RNPY2RNPY5R
SCHEMBL29613396 0.82 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5R
SCHEMBL16860710 0.81 SLC7A5 (0.66) SLC7A5
SCHEMBL30839475 0.81 SLC7A5 (0.61) NPY4RNPY1RNPY2RSLC7A5
SCHEMBL678159 0.81 SLC7A5 (0.61) NPY4RNPY1RNPY2RSLC7A5
SCHEMBL29657676 0.81 SLC7A5 (0.61) NPY4RNPY1RNPY2RSLC7A5
SCHEMBL678158 0.81 SLC7A5 (0.61) NPY4RNPY1RNPY2RSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0264953-B1 USE OF N,N'-BIS-L-AMINO ACID-L-CYSTIN PEPTIDES IN AMINO ACID PREPARATIONS FOR ORAL AND PARENTERAL ADMINISTRATION PFRIMMER KABI GMBH & CO. KG (DE) 1991-05-08 — — EP disclosed
EP-0087751-A2 Water-soluble peptides from very poorly soluble amino acids PFRIMMER KABI GMBH & CO. KG (DE) 1983-09-07 — — EP disclosed
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