Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 2/20 | 0.67 |
| ▸ | ITGB3 | P05106 | 8/20 | 0.63 |
| ▸ | ITGA2B | P08514 | 8/20 | 0.63 |
| ▸ | TACR1 | P25103 | 2/20 | 0.60 |
| ▸ | GPR34 | Q9UPC5 | 1/20 | 0.60 |
| ▸ | CTSL | P07711 | 1/20 | 0.58 |
| ▸ | CTSB | P07858 | 1/20 | 0.58 |
| ▸ | CTSS | P25774 | 1/20 | 0.58 |
| ▸ | CTSK | P43235 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL2969722 | 1.00 | PPARA (0.67) | PPARAITGB3ITGA2BTACR1GPR34 | |
| SCHEMBL7307413 | 1.00 | PPARA (0.67) | PPARAITGB3ITGA2BTACR1GPR34 | |
| SCHEMBL5399121 | 0.93 | GPR34 (0.71) | PPARAITGB3ITGA2BGPR34 | |
| SCHEMBL11581034 | 0.92 | PPARA (0.58) | PPARAITGB3ITGA2BTACR1GPR34 | |
| SCHEMBL11581039 | 0.92 | PPARA (0.58) | PPARAITGB3ITGA2BTACR1GPR34 | |
| SCHEMBL2855187 | 0.92 | PPARA (0.61) | PPARAITGB3ITGA2BTACR1CTSL | |
| SCHEMBL2855186 | 0.92 | PPARA (0.61) | PPARAITGB3ITGA2BTACR1CTSL | |
| Hypochlorous Acid SCHEMBL7368156 | 0.92 | TACR1 (0.65) | ITGB3ITGA2BTACR1CTSLCTSB | |
| SCHEMBL220648 | 0.92 | TACR1 (0.68) | ITGB3ITGA2BTACR1CTSLCTSB | |
| SCHEMBL219151 | 0.92 | TACR1 (0.68) | ITGB3ITGA2BTACR1CTSLCTSB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0237082-B1 | 3,5-DISUBSTITUTED 4,5-DIHYDROISOXAZOLES AS TRANSGLUTAMINASE INHIBITORS | SYNTEX (U.S.A.) INC. (US) | 1991-05-29 | — | — | EP | disclosed |
| US-4929630-A | SKIN DISORDERS, ACNE, 4,5-DIHYDROISOOXAZOLE PEPTIDES | SYNTEX (U.S.A.) INC. (US) | 1990-05-29 | — | — | US | disclosed |
| US-4912120-A | Containing amine and amide substitution | SYNTEX (U.S.A.) INC. (US) | 1990-03-27 | — | — | US | disclosed |
| EP-0237082-A2 | 3,5-disubstituted 4,5-dihydroisoxazoles as transglutaminase inhibitors | SYNTEX (U.S.A.) INC. (US) | 1987-09-16 | — | — | EP | disclosed |