Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 4/20 | 0.35 |
| ▸ | ACACB | O00763 | 3/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | GPR132 | Q9UNW8 | 3/20 | 0.33 |
| ▸ | PREP | P48147 | 1/20 | 0.33 |
| ▸ | FAP | Q12884 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TNKS | O95271 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.32 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.32 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | VNN1 | O95497 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4050112 | 0.93 | CTSK (0.38) | CTSKACACBPAX8CHRNA7ALDH1A1 | |
| SCHEMBL4050440 | 0.92 | CTSK (0.43) | CTSKPAX8CHRNA7ALDH1A1 | |
| SCHEMBL4044772 | 0.89 | CTSV (0.39) | CTSKGPR132CHRNA7HRH3 | |
| SCHEMBL4047771 | 0.89 | CTSK (0.39) | CTSKACACBGPR132CHRNA7 | |
| SCHEMBL4041663 | 0.88 | CTSK (0.35) | CTSKACACBPAX8GPR132PREP | |
| SCHEMBL4043031 | 0.87 | HTRA1 (0.37) | CTSKACACBPAX8GPR132CHRNA7 | |
| SCHEMBL4045728 | 0.87 | CTSK (0.35) | CTSKACACBPAX8GPR132PREP | |
| SCHEMBL4047173 | 0.87 | SMYD3 (0.35) | GPR132PREPFAPALDH1A1 | |
| SCHEMBL4046542 | 0.86 | POLB (0.36) | CTSKACACBPAX8GPR132ALDH1A1 | |
| SCHEMBL4046060 | 0.86 | CTSK (0.35) | CTSKACACBPAX8GPR132PREP |
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 |