Known targets — ChEMBL curated mechanism
PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Phenylalanine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 known ✓ | P23219 | 1/20 | 0.34 |
| ▸ | ANPEP | P15144 | 1/20 | 0.36 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.36 |
| ▸ | DNPEP | Q9ULA0 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | PLAU | P00749 | 2/20 | 0.34 |
| ▸ | PLAUR | Q03405 | 2/20 | 0.34 |
| ▸ | ALPI | P09923 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | XIAP | P98170 | 1/20 | 0.34 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.34 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.34 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 3/20 | 0.32 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Phenylalanine SCHEMBL1239317 | 0.93 | ANPEP (0.33) | ANPEPRNPEPDNPEPTHRBMMP2 | |
| Phenylalanine SCHEMBL1239600 | 0.91 | GHSR (0.35) | ANPEPRNPEPDNPEPOPRK1 | |
| Tyrosine SCHEMBL29194960 | 0.90 | GLP1R (0.38) | — | |
| Phenylalanine SCHEMBL1239596 | 0.87 | GHSR (0.33) | — | |
| Histidine SCHEMBL3791713 | 0.85 | GSR (0.36) | THRBSLC7A5ITGB3ITGA2BERAP2 | |
| Tryptophan SCHEMBL17181205 | 0.84 | GHSR (0.44) | — | |
| Histidine SCHEMBL21768802 | 0.84 | GSR (0.37) | THRBSLC7A5ITGB3ITGA2BERAP2 | |
| Histidine SCHEMBL28378561 | 0.84 | GSR (0.37) | THRBSLC7A5ITGB3ITGA2BERAP2 | |
| Dl-Phenylalanine SCHEMBL27980641 | 0.84 | SLC7A5 (0.41) | ANPEPRNPEPDNPEPALPIPKM | |
| Histidine SCHEMBL14691272 | 0.84 | GSR (0.40) | THRBSLC7A5ITGB3ITGA2BERAP2 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2459207-A2 | PHARMACEUTICAL COMPOSITION FOR TREATING MEDICAL CONDITIONS AND A METHOD FOR TREATING ALIMENTARY DISORDERS AND RELATED DISEASES | SOCIEDADE BENEFICENTE DE SENHORAS HOSPITAL SÍRIO E LIBANÊS (BR) | 2012-06-06 | — | — | EP | disclosed |
| WO-2011011847-A2 | PHARMACEUTICAL COMPOSITION FOR TREATING MEDICAL CONDITIONS AND A METHOD FOR TREATING ALIMENTARY DISORDERS AND RELATED DISEASES | SOCIEDADE BENEFICIENTE DE SENHORAS HOSPITAL SIRIO LIBANES (BR) | 2011-02-03 | — | — | WO | disclosed |