Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CTSK | P43235 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.43 |
| ▸ | MME | P08473 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6402737 | 1.00 | HTT (0.50) | HTTSMN1; SMN2CTSKALDH1A1POLB | |
| SCHEMBL6406973 | 1.00 | HTT (0.50) | HTTSMN1; SMN2CTSKALDH1A1POLB | |
| SCHEMBL6406963 | 1.00 | HTT (0.50) | HTTSMN1; SMN2CTSKALDH1A1POLB | |
| SCHEMBL6402731 | 1.00 | HTT (0.50) | HTTSMN1; SMN2CTSKALDH1A1POLB | |
| SCHEMBL6404513 | 0.86 | POLB (0.45) | HTTSMN1; SMN2ALDH1A1POLBKDM4E | |
| SCHEMBL6406305 | 0.86 | POLB (0.45) | HTTSMN1; SMN2ALDH1A1POLBKDM4E | |
| SCHEMBL6403644 | 0.79 | CTSK (0.48) | HTTSMN1; SMN2CTSKALDH1A1POLB | |
| SCHEMBL6403638 | 0.79 | CTSK (0.48) | HTTSMN1; SMN2CTSKALDH1A1POLB | |
| SCHEMBL6607233 | 0.77 | CTSK (0.71) | HTTSMN1; SMN2CTSKALDH1A1ALOX12 | |
| SCHEMBL6604125 | 0.77 | CTSK (0.71) | HTTSMN1; SMN2CTSKALDH1A1ALOX12 |
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-1411933-A1 | ALPHA-KETOAMIDE DERIVATIVES AS CATHEPSIN K INHIBITORS | SmithKline Beecham Corporation (US) | 2004-04-28 | — | — | EP | disclosed |
| WO-2003013518-A1 | ALPHA-KETOAMIDE DERIVATIVES AS CATHEPSIN K INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-02-20 | — | — | WO | disclosed |