Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.50 |
| ▸ | IDH1 | O75874 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | IDH2 | P48735 | 1/20 | 0.39 |
| ▸ | GHSR | Q92847 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10823647 | 0.87 | IDH1 (0.44) | PTGESIDH1MEN1KMT2AMAPT | |
| SCHEMBL10823472 | 0.86 | PTGES (0.46) | PTGESMEN1KMT2ATRPV1MAPT | |
| SCHEMBL10823664 | 0.84 | PTGES (0.47) | PTGESMEN1KMT2AGAAALDH1A1 | |
| SCHEMBL10823369 | 0.84 | NT5E (0.47) | IDH1MEN1KMT2AMAPTIDH2 | |
| SCHEMBL10823352 | 0.83 | PTGES (0.41) | PTGESIDH1MEN1KMT2AGAA | |
| SCHEMBL10823443 | 0.82 | MEN1 (0.44) | PTGESIDH1MEN1KMT2AMAPT | |
| SCHEMBL11337453 | 0.82 | ENPP2 (0.45) | PTGESIDH1MEN1KMT2ATRPV1 | |
| SCHEMBL10823374 | 0.81 | IDH1 (0.48) | PTGESIDH1MEN1KMT2ATRPV1 | |
| SCHEMBL10823363 | 0.81 | IDH1 (0.58) | IDH1IDH2 | |
| SCHEMBL10823376 | 0.81 | PKM (0.46) | IDH1MEN1KMT2AMAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-H83-H | Dental antiplaque agents and inhibitors of connective tissue destruction | AMERICAN CYANAMID COMPANY (US) | 1986-07-01 | — | — | US | disclosed |