Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.40 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL10076580 | 0.87 | PRSS1 (0.41) | PRSS1PRSS2PRSS3ALDH1A1CYP3A4 | |
| SCHEMBL322223 | 0.86 | PRSS1 (0.41) | PRSS1PRSS2PRSS3ALDH1A1CYP3A4 | |
| SCHEMBL320991 | 0.79 | PRSS1 (0.43) | PRSS1PRSS2PRSS3ALDH1A1CYP3A4 | |
| SCHEMBL2237873 | 0.78 | ALDH1A1 (0.53) | PRSS1PRSS2PRSS3ALDH1A1CYP3A4 | |
| SCHEMBL320723 | 0.75 | ALDH1A1 (0.50) | PRSS1PRSS2PRSS3ALDH1A1CYP3A4 | |
| SCHEMBL15463917 | 0.74 | ALDH1A1 (0.49) | PRSS1PRSS2PRSS3ALDH1A1CYP3A4 | |
| SCHEMBL21415646 | 0.74 | ALDH1A1 (0.49) | PRSS1PRSS2PRSS3ALDH1A1CYP3A4 | |
| SCHEMBL13280839 | 0.72 | PRSS1 (0.44) | PRSS1PRSS2PRSS3ALDH1A1CYP3A4 | |
| SCHEMBL20253254 | 0.71 | ALDH1A1 (0.40) | PRSS1PRSS2PRSS3ALDH1A1CYP3A4 | |
| SCHEMBL20253265 | 0.71 | PRSS1 (0.38) | PRSS1PRSS2PRSS3ALDH1A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012003919-A2 | SEMICONDUCTING POLYMERS | MERCK PATENT GMBH (DE) | 2012-01-12 | — | — | WO | disclosed |