Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.56 |
| ▸ | CTSK | P43235 | 1/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 6/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.55 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | SLC22A6 | Q4U2R8 | 2/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL1177114 | 0.83 | PTGS2 (0.64) | PTGS1PTGS2SLC22A6AKR1C3AKR1C2 | |
| SCHEMBL6619802 | 0.82 | CTSK (0.72) | CTSLCTSKPSEN1PSEN2APH1B | |
| SCHEMBL9261215 | 0.81 | CTSK (0.50) | CTSLCTSKSMN1; SMN2LMNAHIF1A | |
| SCHEMBL27403095 | 0.81 | PTGS2 (0.69) | PTGS1PTGS2MAPTCXCR1CXCR2 | |
| SCHEMBL31261540 | 0.81 | PTGS2 (0.69) | PTGS1PTGS2MAPTCXCR1CXCR2 | |
| Butanone SCHEMBL6622004 | 0.80 | CTSL (0.49) | CTSLCTSKALDH1A1PSEN1PSEN2 | |
| SCHEMBL5155418 | 0.79 | CTSL (0.49) | CTSLCTSKSMN1; SMN2LMNAHIF1A | |
| SCHEMBL5249260 | 0.78 | CTSL (0.48) | CTSLCTSKSMN1; SMN2LMNAHIF1A | |
| SCHEMBL29793885 | 0.78 | CTSL (0.48) | CTSLCTSKSMN1; SMN2LMNAHIF1A | |
| SCHEMBL5216832 | 0.78 | CTSL (0.48) | CTSLCTSKSMN1; SMN2LMNAHIF1A |
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-1067894-A4 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2004-09-08 | — | — | EP | disclosed |
| US-6518267-B1 | Protease inhibitors | SMITHKLINE BEECHAM CORPORATION | 2003-02-11 | — | — | US | disclosed |
| EP-1067894-A2 | PROTEASE INHIBITORS | SmithKline Beecham Corporation (US) | 2001-01-17 | — | — | EP | disclosed |
| WO-1999059526-A2 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-11-25 | — | — | WO | disclosed |