Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB1 | P15086 | 2/20 | 0.45 |
| ▸ | CTSL | P07711 | 2/20 | 0.44 |
| ▸ | KLK7 | P49862 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SYK | P43405 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | FKBP1A | P62942 | 3/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5941298 | 1.00 | CPB1 (0.45) | CPB1CTSLKLK7ALDH1A1GAA | |
| SCHEMBL18335958 | 0.92 | CPB1 (0.46) | CPB1CTSLKLK7ALDH1A1GAA | |
| SCHEMBL6347376 | 0.92 | CPB1 (0.46) | CPB1CTSLKLK7ALDH1A1GAA | |
| SCHEMBL18337377 | 0.91 | CPB1 (0.48) | CPB1CTSLKLK7ALDH1A1GAA | |
| SCHEMBL32672364 | 0.90 | CPB1 (0.53) | CPB1CTSLKLK7ALDH1A1GAA | |
| SCHEMBL25907340 | 0.90 | CPB1 (0.53) | CPB1CTSLKLK7ALDH1A1GAA | |
| SCHEMBL14468657 | 0.88 | ALDH1A1 (0.47) | CPB1CTSLKLK7ALDH1A1GAA | |
| SCHEMBL5941341 | 0.88 | ALDH1A1 (0.47) | CPB1CTSLKLK7ALDH1A1GAA | |
| SCHEMBL31058400 | 0.88 | ALDH1A1 (0.47) | CPB1CTSLKLK7ALDH1A1GAA | |
| SCHEMBL4040280 | 0.88 | ALDH1A1 (0.47) | CPB1CTSLKLK7ALDH1A1GAA |
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-1546150-B1 | PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES | AMURA THERAPEUTICS LTD (GB) | 2009-03-04 | — | — | EP | disclosed |
| EP-1546150-A1 | BIOLOGICALLY ACTIVE COMPOUNDS | Amura Therapeutics Limited (GB) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004007501-A1 | BIOLOGICALLY ACTIVE COMPOUNDS | AMURA THERAPEUTICS LIMITED (GB) | 2004-01-22 | — | — | WO | disclosed |