Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 7/20 | 0.45 |
| ▸ | CTSL | P07711 | 2/20 | 0.40 |
| ▸ | CTSS | P25774 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CTSV | O60911 | 1/20 | 0.34 |
| ▸ | CTSB | P07858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4051523 | 0.93 | ALDH1A1 (0.37) | CTSKCTSLCTSSALDH1A1HPGD | |
| SCHEMBL4049357 | 0.89 | CTSK (0.37) | CTSKCTSLCTSSALDH1A1HPGD | |
| SCHEMBL4045412 | 0.89 | CTSK (0.48) | CTSKCTSLCTSSCTSVCTSB | |
| SCHEMBL4045839 | 0.87 | CTSK (0.45) | CTSKCTSLCTSSCTSVCTSB | |
| SCHEMBL4042896 | 0.87 | CTSK (0.45) | CTSKCTSLCTSSHPGDCTSV | |
| SCHEMBL4043661 | 0.85 | ALDH1A1 (0.38) | CTSKCTSLCTSSALDH1A1HPGD | |
| SCHEMBL4051337 | 0.84 | CHRNB2 (0.43) | CTSKALDH1A1NPSR1 | |
| SCHEMBL4046943 | 0.83 | CTSK (0.50) | CTSKCTSLCTSSALDH1A1KDM4E | |
| SCHEMBL4045548 | 0.83 | CTSK (0.51) | CTSKCTSLCTSSALDH1A1KDM4E | |
| SCHEMBL4047709 | 0.82 | ALDH1A1 (0.34) | CTSKCTSLCTSSALDH1A1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1546150-B1 | PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES | AMURA THERAPEUTICS LTD (GB) | 2009-03-04 | — | — | EP | claimed |