Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | AGXT | P21549 | 2/20 | 0.37 |
| ▸ | APP | P05067 | 5/20 | 0.37 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL353344 | 0.87 | MEN1 (0.43) | IDO1AGXTAPPTBXAS1CA1 | |
| SCHEMBL17305606 | 0.87 | MEN1 (0.43) | IDO1AGXTAPPTBXAS1CA1 | |
| SCHEMBL26512096 | 0.79 | CA1 (0.45) | IDO1AGXTAPPTBXAS1CA1 | |
| SCHEMBL7140177 | 0.74 | TBXAS1 (0.43) | IDO1AGXTTBXAS1CALM1 | |
| SCHEMBL13030081 | 0.74 | TBXAS1 (0.43) | IDO1AGXTTBXAS1CALM1 | |
| SCHEMBL7140172 | 0.74 | TBXAS1 (0.43) | IDO1AGXTTBXAS1CALM1 | |
| SCHEMBL26985881 | 0.73 | CYP2C9 (0.53) | IDO1AGXTAPPTBXAS1CA1 | |
| SCHEMBL12769997 | 0.72 | SLC6A4 (0.49) | IDO1AGXTAPPCA1CA2 | |
| SCHEMBL27032518 | 0.72 | SLC6A4 (0.49) | IDO1AGXTAPPCA1CA2 | |
| SCHEMBL27131530 | 0.72 | SLC6A4 (0.49) | IDO1AGXTAPPCA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2231590-B9 | ANTITUMORAL COMPOUNDS | PHARMA MAR SA (ES) | 2012-08-15 | — | — | EP | disclosed |
| EP-2231590-B1 | ANTITUMORAL COMPOUNDS | PHARMA MAR SA (ES) | 2012-03-14 | — | — | EP | disclosed |