Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PREP | P48147 | 4/20 | 0.46 |
| ▸ | CA1 | P00915 | 5/20 | 0.39 |
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | AGXT | P21549 | 2/20 | 0.35 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL31643222 | 0.91 | PREP (0.49) | PREPCA1CA12CA9IDO1 | |
| SCHEMBL7258421 | 0.85 | PREP (0.43) | PREPCA1CA12CA9NAAA | |
| SCHEMBL4496052 | 0.82 | PREP (0.48) | PREPCA1CA12CA9IDO1 | |
| SCHEMBL6156659 | 0.82 | IDO1 (0.55) | PREPIDO1AGXT | |
| SCHEMBL12201060 | 0.82 | PREP (0.59) | PREPCA1CA12CA9DRD2 | |
| SCHEMBL23043072 | 0.82 | PREP (0.43) | PREPCA1CA12CA9IDO1 | |
| SCHEMBL12426281 | 0.82 | PREP (0.46) | PREPCA1CA12CA9KMT2A | |
| SCHEMBL26490978 | 0.81 | PREP (0.42) | PREPCA1CA12CA9IDO1 | |
| SCHEMBL22924668 | 0.81 | IDO1 (0.41) | PREPCA1CA12CA9DRD2 | |
| SCHEMBL18558089 | 0.80 | PREP (0.41) | PREPCA1CA12CA9IDO1 |
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-0550924-A1 | 2-Pyrrolidinone derivatives as HIV protease inhibitors | MERCK & CO. INC. (US) | 1993-07-14 | — | — | EP | disclosed |