Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 8/20 | 0.43 |
| ▸ | CTSV | O60911 | 4/20 | 0.43 |
| ▸ | CTSL | P07711 | 4/20 | 0.43 |
| ▸ | CTSS | P25774 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | STAT1 | P42224 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6648974 | 0.72 | CTSK (0.45) | CTSKCTSLCTSSCYP1A2CYP2C19 | |
| SCHEMBL22777304 | 0.69 | EPHX1 (0.51) | CTSKCTSVCTSLCTSSSMN1; SMN2 | |
| SCHEMBL12166465 | 0.67 | CTSK (0.62) | CTSKCTSVCTSLCTSS | |
| SCHEMBL2634138 | 0.65 | MEN1 (0.61) | GAAMAPTKMT2ATP53CYP1A2 | |
| SCHEMBL27780890 | 0.65 | HDAC4 (0.54) | CTSKCTSVCTSLCTSSSMN1; SMN2 | |
| SCHEMBL4908419 | 0.64 | NPC1 (0.44) | CTSKCTSLCTSSCYP1A2CYP2C19 | |
| SCHEMBL11436844 | 0.64 | FAAH (0.55) | CTSKCTSLCTSSCYP1A2 | |
| SCHEMBL9533470 | 0.64 | KMT2A (0.77) | GAAMAPTKMT2ATP53CYP1A2 | |
| SCHEMBL16545296 | 0.64 | KMT2A (0.59) | GAAMAPTKMT2ATP53CYP1A2 | |
| Hydrochloric Acid SCHEMBL4446986 | 0.64 | HDAC4 (0.53) | CTSKCTSVCTSLCTSSSMN1; SMN2 |
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 |