Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 5/20 | 0.34 |
| ▸ | ADH1B | P00325 | 1/20 | 0.32 |
| ▸ | ADH1C | P00326 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.32 |
| ▸ | ADH4 | P08319 | 1/20 | 0.32 |
| ▸ | ADH7 | P40394 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Nonane SCHEMBL3071312 | 0.85 | NAAA (0.58) | NAAAMEN1KMT2ATSHRTHRB | |
| SCHEMBL5571386 | 0.85 | NAAA (0.58) | NAAAMEN1KMT2ATSHRTHRB | |
| SCHEMBL37419 | 0.85 | NAAA (0.58) | NAAAMEN1KMT2ATSHRTHRB | |
| SCHEMBL1493031 | 0.85 | NAAA (0.58) | NAAAMEN1KMT2ATSHRTHRB | |
| SCHEMBL10870593 | 0.85 | NAAA (0.58) | NAAAMEN1KMT2ATSHRTHRB | |
| SCHEMBL10791564 | 0.85 | NAAA (0.58) | NAAAMEN1KMT2ATSHRTHRB | |
| SCHEMBL527174 | 0.85 | NAAA (0.58) | NAAAMEN1KMT2ATSHRTHRB | |
| SCHEMBL15486455 | 0.85 | NAAA (0.58) | NAAAMEN1KMT2ATSHRTHRB | |
| SCHEMBL5575642 | 0.85 | NAAA (0.58) | NAAAMEN1KMT2ATSHRTHRB | |
| Hexane SCHEMBL2866709 | 0.85 | NAAA (0.58) | NAAAMEN1KMT2ATSHRTHRB |
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 |