Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.74 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.74 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.74 |
| ▸ | SCN7A | Q01118 | 2/20 | 0.64 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HRH2 | P25021 | 1/20 | 0.50 |
| ▸ | HRH1 | P35367 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Carbamic Acid SCHEMBL6896424 | 0.95 | TPSAB1 (0.67) | TPSAB1TPSD1TPSG1SCN7AKCNH2 | |
| SCHEMBL656573 | 0.85 | TPSAB1 (0.78) | TPSAB1TPSD1TPSG1ALDH1A1MAPT | |
| SCHEMBL170018 | 0.84 | TPSAB1 (0.76) | TPSAB1TPSD1TPSG1ALDH1A1SMN1; SMN2 | |
| SCHEMBL27956550 | 0.84 | TPSAB1 (0.76) | TPSAB1TPSD1TPSG1ALDH1A1SMN1; SMN2 | |
| SCHEMBL653051 | 0.84 | TPSAB1 (0.76) | TPSAB1TPSD1TPSG1ALDH1A1MAPT | |
| SCHEMBL654109 | 0.84 | TPSAB1 (0.76) | TPSAB1TPSD1TPSG1ALDH1A1SMN1; SMN2 | |
| SCHEMBL652762 | 0.84 | TPSAB1 (0.76) | TPSAB1TPSD1TPSG1ALDH1A1SMN1; SMN2 | |
| SCHEMBL5072941 | 0.83 | MEN1 (0.78) | TPSAB1TPSD1TPSG1ALDH1A1SMN1; SMN2 | |
| SCHEMBL29883359 | 0.82 | TPSAB1 (0.58) | TPSAB1TPSD1TPSG1SCN7AKCNH2 | |
| SCHEMBL26699227 | 0.82 | TPSAB1 (0.58) | TPSAB1TPSD1TPSG1SCN7AKCNH2 |
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-1126833-A4 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES INC (US) | 2004-09-08 | — | — | EP | disclosed |
| EP-1126833-A2 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000025768-A1 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2000-05-11 | — | — | WO | disclosed |