Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 9/20 | 0.52 |
| ▸ | TP53 | P04637 | 4/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | THRB | P10828 | 2/20 | 0.44 |
| ▸ | DHODH | Q02127 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 7/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | HTT | P42858 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19003254 | 0.89 | EGFR (0.53) | EGFRMAPTTP53SMN1; SMN2TDP1 | |
| SCHEMBL19003251 | 0.83 | EGFR (0.68) | EGFRMAPTTP53SMN1; SMN2KDM4E | |
| SCHEMBL19003284 | 0.82 | MAPT (0.58) | MAPTTP53SMN1; SMN2POLBMEN1 | |
| SCHEMBL19003280 | 0.81 | MAPT (0.52) | MAPTTP53CA2CA4CA5A | |
| SCHEMBL19003279 | 0.80 | ALDH1A1 (0.47) | EGFRMAPTTP53SMN1; SMN2KDM4E | |
| SCHEMBL19003456 | 0.80 | MAPT (0.48) | EGFRMAPTTP53SMN1; SMN2THRB | |
| SCHEMBL18985272 | 0.80 | MAOB (0.63) | EGFRMAPTTP53SMN1; SMN2MEN1 | |
| SCHEMBL19003250 | 0.80 | MAPT (0.51) | EGFRMAPTTP53SMN1; SMN2THRB | |
| SCHEMBL19003247 | 0.79 | MAPT (0.60) | EGFRMAPTSMN1; SMN2KDM4EPOLB | |
| SCHEMBL15708821 | 0.78 | EPHX1 (0.68) | MAPTTP53CA2CA4CA5A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017102014-A1 | PROPENAMIDE THIOPHENE DERIVATIVES AS FLAVIVIRUS INHIBITORS AND THEIR USE | UNIVERSITE D'AIX-MARSEILLE (FR) | 2017-06-22 | — | — | WO | disclosed |