Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 3/20 | 0.38 |
| ▸ | PTGER2 | P43116 | 5/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.31 |
| ▸ | F2 | P00734 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSS | P25774 | 1/20 | 0.31 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.31 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | TNKS | O95271 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.30 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.30 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4045088 | 0.90 | CTSS (0.37) | CTSKPTGER2CALCRLCTSBCTSS | |
| SCHEMBL4045645 | 0.88 | SMYD3 (0.34) | CTSKPTGER2F2CTSBCTSS | |
| SCHEMBL4052140 | 0.85 | HSD17B10 (0.36) | CTSKALDH1A1KMT2AHCRTR2 | |
| SCHEMBL4048509 | 0.85 | CTSK (0.38) | CTSKPAX8F2ALDH1A1SIGMAR1 | |
| SCHEMBL4044151 | 0.84 | CTSK (0.43) | CTSKCTSSALDH1A1L3MBTL1 | |
| SCHEMBL4051458 | 0.84 | CTSK (0.36) | CTSKCALCRL | |
| SCHEMBL4050112 | 0.82 | CTSK (0.38) | CTSKPAX8F2ALDH1A1SIGMAR1 | |
| SCHEMBL4043616 | 0.80 | CTSK (0.35) | CTSKPAX8ALDH1A1L3MBTL1 | |
| SCHEMBL4044148 | 0.80 | CTSK (0.42) | CTSKCTSBCTSS | |
| SCHEMBL4046060 | 0.79 | CTSK (0.35) | CTSKPAX8F2ALDH1A1L3MBTL1 |
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 |