Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.42 |
| ▸ | AGXT | P21549 | 2/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 5/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | REN | P00797 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18475579 | 0.84 | APP (0.44) | IDO1AGXTNAAAAPPMAOB | |
| SCHEMBL12182455 | 0.83 | MAOB (0.33) | IDO1AGXTAPPMAOBMAPT | |
| SCHEMBL28811360 | 0.79 | IDO1 (0.52) | IDO1AGXTNAAAAPPMAOB | |
| SCHEMBL15007794 | 0.75 | IDO1 (0.37) | IDO1AGXTNAAAAPPMAOB | |
| SCHEMBL15007796 | 0.75 | IDO1 (0.37) | IDO1AGXTNAAAAPPMAOB | |
| SCHEMBL16654046 | 0.74 | NAAA (0.54) | IDO1AGXTNAAAAPPMAOB | |
| SCHEMBL15032462 | 0.74 | IDO1 (0.40) | IDO1AGXTNAAAAPPREN | |
| SCHEMBL18404313 | 0.73 | NFKB1 (0.30) | — | |
| SCHEMBL12182467 | 0.72 | MAOB (0.36) | IDO1MAOB | |
| SCHEMBL14616127 | 0.70 | — | — |
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-9611287-B2 | Trioxacarcins and uses thereof | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2017-04-04 | — | — | US | disclosed |