Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 9/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | PNP | P00491 | 2/20 | 0.31 |
| ▸ | PAH | P00439 | 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 | |
|---|---|---|---|---|
| SCHEMBL2448381 | 0.95 | HPRT1 (0.40) | HPRT1ALDH1A1NOS1PAH | |
| SCHEMBL9020214 | 0.93 | HPRT1 (0.39) | HPRT1ALDH1A1NOS1PAH | |
| SCHEMBL7166497 | 0.86 | HPRT1 (0.42) | HPRT1NOS1PNPPAH | |
| SCHEMBL598708 | 0.86 | HPRT1 (0.42) | HPRT1NOS1PNPPAH | |
| SCHEMBL9615455 | 0.86 | HPRT1 (0.42) | HPRT1NOS1PNPPAH | |
| SCHEMBL9407058 | 0.86 | HPRT1 (0.35) | HPRT1NOS1 | |
| SCHEMBL9020049 | 0.82 | HPRT1 (0.41) | HPRT1PNP | |
| SCHEMBL9020256 | 0.81 | HPRT1 (0.36) | HPRT1ALDH1A1NOS1 | |
| SCHEMBL9020313 | 0.81 | HPRT1 (0.42) | HPRT1NOS1 | |
| SCHEMBL9309013 | 0.80 | HPRT1 (0.42) | HPRT1NOS1PNPPAH |
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-0458312-B1 | Novel cyclobutane derivatives | NIPPON KAYAKU KK (JP) | 1996-03-20 | — | — | EP | disclosed |
| US-5324730-A | Viricides | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1994-06-28 | — | — | US | disclosed |
| EP-0458312-A1 | Novel cyclobutane derivatives | Nippon Kayaku Kabushiki Kaisha (JP) | 1991-11-27 | — | — | EP | disclosed |