SCHEMBL2347308

SCHEMBL2347308

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

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 5/20 0.36
▸ ITGA2B P08514 5/20 0.36
▸ NPY4R P50391 9/20 0.35
▸ NPY1R P25929 7/20 0.35
▸ NPY2R P49146 5/20 0.35
▸ NPY5R Q15761 5/20 0.35
▸ FOLH1 Q04609 1/20 0.35
▸ GNPAT O15228 1/20 0.34
▸ C3AR1 Q16581 1/20 0.34

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
SCHEMBL14199862 0.86 NPY4R (0.40) ITGB3ITGA2BNPY4RNPY1RNPY2R
SCHEMBL2481089 0.85 NPY4R (0.37) ITGB3ITGA2BNPY4RNPY1RNPY2R
SCHEMBL9488991 0.85 NPY4R (0.37) ITGB3ITGA2BNPY4RNPY1RNPY2R
Hydrochloric Acid SCHEMBL27645702 0.82 NPY4R (0.36) ITGB3ITGA2BNPY4RNPY1RNPY2R
SCHEMBL1263209 0.80 FOLH1 (0.39) ITGB3ITGA2BNPY4RNPY1RNPY2R
SCHEMBL61231 0.80 FOLH1 (0.39) ITGB3ITGA2BNPY4RNPY1RNPY2R
SCHEMBL933117 0.80 C3AR1 (0.38) ITGB3ITGA2BNPY4RNPY1RNPY2R
SCHEMBL933116 0.80 C3AR1 (0.38) ITGB3ITGA2BNPY4RNPY1RNPY2R
SCHEMBL2483025 0.80 C3AR1 (0.34) ITGB3ITGA2BNPY4RNPY1RNPY2R
SCHEMBL9924206 0.80 C3AR1 (0.34) ITGB3ITGA2BNPY4RNPY1RNPY2R

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
EP-1582208-B1 An amino acid compositions for promoting collagen synthesis AJINOMOTO KK (JP) 2011-08-24 — — EP disclosed
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