Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 3/20 | 0.48 |
| ▸ | CTSK | P43235 | 2/20 | 0.48 |
| ▸ | CTSL | P07711 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5637603 | 1.00 | CTSS (0.48) | CTSSCTSKCTSLKMT2AMEN1 | |
| SCHEMBL14260206 | 0.90 | CTSK (0.47) | CTSSCTSKCTSLKMT2AMEN1 | |
| SCHEMBL14260209 | 0.89 | CTSS (0.48) | CTSSCTSKCTSLKMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL4907356 | 0.88 | CTSS (0.48) | CTSSCTSKCTSLKMT2AMEN1 | |
| SCHEMBL4906490 | 0.85 | CTSS (0.44) | CTSSCTSLKMT2AMEN1ALDH1A1 | |
| SCHEMBL4906479 | 0.83 | CTSS (0.45) | CTSSCTSKCTSLKMT2AMEN1 | |
| SCHEMBL6488436 | 0.83 | CTSK (0.64) | CTSSCTSKCTSLKMT2AMEN1 | |
| SCHEMBL6488429 | 0.83 | CTSK (0.64) | CTSSCTSKCTSLKMT2AMEN1 | |
| SCHEMBL14260210 | 0.82 | CTSK (0.67) | CTSSCTSKCTSLMMP1MMP3 | |
| SCHEMBL4817847 | 0.81 | EPHX2 (0.49) | CTSKKMT2AMEN1HSD17B10EPHX2 |
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-1465862-A1 | CYCLOALKYL KETOAMIDES DERIVATIVES USEFUL AS CATHEPSIN K INHIBITORS | SmithKline Beecham Corporation (US) | 2004-10-13 | — | — | EP | disclosed |
| WO-2003062192-A1 | CYCLOALKYL KETOAMIDES DERIVATIVES USEFUL AS CATHEPSIN K INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-07-31 | — | — | WO | disclosed |