Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 5/20 | 0.52 |
| ▸ | APP | P05067 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | AGXT | P21549 | 2/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL62037 | 0.87 | IDO1 (0.59) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| Hydrochloric Acid SCHEMBL5797813 | 0.85 | IDO1 (0.60) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL6624910 | 0.85 | IDO1 (0.57) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL7554673 | 0.82 | TSHR (0.37) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| SCHEMBL12308295 | 0.81 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL1127531 | 0.79 | LTA4H (0.67) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL728403 | 0.79 | IDO1 (0.56) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL1145765 | 0.78 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL769511 | 0.78 | IDO1 (0.59) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 | |
| SCHEMBL10064850 | 0.78 | IDO1 (0.55) | ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0977730-B1 | AMINO ACID DERIVATIVES INHIBITING EXTRACELLULAR MATRIX METALLOPROTEINASE AND TNF ALPHA RELEASE | CHIESI FARMA SPA (IT) | 2003-03-12 | — | — | EP | disclosed |
| EP-0977730-A1 | AMINO ACID DERIVATIVES INHIBITING EXTRACELLULAR MATRIX METALLOPROTEINASE AND TNF ALPHA RELEASE | CHIESI FARMACEUTICI S.p.A. (IT) | 2000-02-09 | — | — | EP | disclosed |
| WO-1998047863-A1 | AMINO ACID DERIVATIVES INHIBITING EXTRACELLULAR MATRIX METALLOPROTEINASE AND TNF ALPHA RELEASE | CHIESI FARMACEUTICI S.P.A. (IT) | 1998-10-29 | — | — | WO | disclosed |