Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 15/20 | 0.36 |
| ▸ | CTSL | P07711 | 14/20 | 0.36 |
| ▸ | CTSK | P43235 | 10/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5402407 | 0.86 | KDM4E (0.45) | KDM4EALDH1A1POLBTDP1L3MBTL1 | |
| SCHEMBL6685716 | 0.78 | KDM4E (0.47) | KDM4EALDH1A1POLBTDP1L3MBTL1 | |
| SCHEMBL3013749 | 0.76 | CTSS (0.51) | CTSSCTSLCTSK | |
| SCHEMBL5843360 | 0.71 | CTSS (0.53) | KDM4EALDH1A1POLBTDP1L3MBTL1 | |
| SCHEMBL4800843 | 0.70 | CTSS (0.51) | KDM4EALDH1A1POLBCTSSCTSL | |
| SCHEMBL3022158 | 0.68 | CTSS (0.49) | CTSSCTSLCTSK | |
| SCHEMBL6689992 | 0.68 | CFD (0.41) | KDM4EALDH1A1POLBEPHX2EPHX1 | |
| SCHEMBL5409955 | 0.67 | EPHX2 (0.47) | ALDH1A1POLBEPHX2EPHX1CTSS | |
| SCHEMBL5404160 | 0.65 | EPHX2 (0.46) | ALDH1A1POLBEPHX2EPHX1CTSS | |
| SCHEMBL6687352 | 0.65 | MAPT (0.45) | ALDH1A1POLB |
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-1658267-A4 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2007-08-01 | — | — | EP | disclosed |
| EP-1658267-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2006-05-24 | — | — | EP | disclosed |
| WO-2005034848-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2005-04-21 | — | — | WO | disclosed |