Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | ESRRG | P62508 | 5/20 | 0.40 |
| ▸ | ESRRB | O95718 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.37 |
| ▸ | GCGR | P47871 | 4/20 | 0.35 |
| ▸ | ADCY6 | O43306 | 2/20 | 0.35 |
| ▸ | ADCY3 | O60266 | 2/20 | 0.35 |
| ▸ | ADCY9 | O60503 | 2/20 | 0.35 |
| ▸ | ADCY5 | O95622 | 2/20 | 0.35 |
| ▸ | ADCY8 | P40145 | 2/20 | 0.35 |
| ▸ | ADCY7 | P51828 | 2/20 | 0.35 |
| ▸ | ADCY2 | Q08462 | 2/20 | 0.35 |
| ▸ | ADCY1 | Q08828 | 2/20 | 0.35 |
| ▸ | ADCY4 | Q8NFM4 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6990056 | 0.92 | OPRM1 (0.37) | LMNAALDH1A1POLB | |
| SCHEMBL6987871 | 0.91 | CTSK (0.39) | TP53THRBESRRGMAPTCTSK | |
| SCHEMBL6988403 | 0.90 | KMT2A (0.35) | MAPTCTSKLMNAALDH1A1 | |
| SCHEMBL6987228 | 0.90 | CTSK (0.37) | TP53THRBESRRGESRRBMAPT | |
| SCHEMBL6990082 | 0.88 | MAPT (0.41) | TP53ESRRGMAPTLMNAALDH1A1 | |
| SCHEMBL6988433 | 0.88 | TAS1R3 (0.35) | ESRRGCTSK | |
| SCHEMBL6981853 | 0.87 | TRPV1 (0.42) | GCGRADCY6ADCY3ADCY9ADCY5 | |
| SCHEMBL6988694 | 0.86 | ATM (0.39) | TP53MAPTLMNAALDH1A1POLB | |
| SCHEMBL6988884 | 0.84 | CTSS (0.36) | CTSKALDH1A1 | |
| SCHEMBL6985501 | 0.83 | GCGR (0.41) | GCGR |
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-1362042-A1 | CYCLIC 2-CARBONYLAMINOKETONES AS INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | Amura Therapeutics Limited (GB) | 2003-11-19 | — | — | EP | disclosed |
| WO-2002057249-A1 | CYCLIC 2-CARBONYLAMINOKETONES AS INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES | AMURA THERAPEUTICS LIMITED (GB) | 2002-07-25 | — | — | WO | disclosed |