Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA6 | P23280 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6614023 | 0.85 | TSHR (0.55) | ALDH1A1MAPTHPGDSMN1; SMN2TSHR | |
| SCHEMBL6613573 | 0.83 | POLB (0.49) | ALDH1A1MAPTHPGDSMN1; SMN2TSHR | |
| SCHEMBL2766821 | 0.82 | RXFP1 (0.52) | ALDH1A1MAPTSMN1; SMN2MAPK1CA12 | |
| SCHEMBL6613333 | 0.81 | TP53 (0.48) | MAPTHPGDSMN1; SMN2TSHRMAPK1 | |
| SCHEMBL6609944 | 0.81 | MAPT (0.49) | ALDH1A1MAPTHPGDSMN1; SMN2KDM4E | |
| SCHEMBL5844388 | 0.79 | CA12 (0.60) | ALDH1A1MAPTHPGDSMN1; SMN2KDM4E | |
| SCHEMBL5739319 | 0.78 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDSMN1; SMN2TSHR | |
| SCHEMBL6206173 | 0.78 | MCHR1 (0.43) | MAPTTP53 | |
| SCHEMBL5735257 | 0.77 | MAPT (0.55) | ALDH1A1MAPTSMN1; SMN2KDM4EGAA | |
| SCHEMBL6610780 | 0.75 | MAPT (0.53) | ALDH1A1MAPTHPGDNPSR1GAA |
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-1463724-A1 | PYRROLIDONE CARBOXAMIDES | Actelion Pharmaceuticals Ltd. (CH) | 2004-10-06 | — | — | EP | disclosed |
| WO-2003059905-A1 | PYRROLIDONE CARBOXAMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2003-07-24 | — | — | WO | disclosed |