Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.39 |
| ▸ | AURKA | O14965 | 2/20 | 0.39 |
| ▸ | RET | P07949 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16275096 | 0.82 | MEN1 (0.43) | EGFRAURKAMEN1KMT2ASGMS2 | |
| SCHEMBL16274771 | 0.81 | MAPT (0.43) | EGFRMAPTAURKBAURKARET | |
| SCHEMBL3516729 | 0.79 | HIF1A (0.50) | EGFRMAPTMEN1KMT2AHIF1A | |
| SCHEMBL16274789 | 0.79 | EGFR (0.42) | EGFRERBB2MAPTAURKBKDM4E | |
| SCHEMBL16274831 | 0.77 | MEN1 (0.46) | MEN1KMT2AKDM4EALDH1A1HTT | |
| SCHEMBL16274762 | 0.73 | KDM4E (0.47) | EGFRMAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL16274598 | 0.71 | KDM4E (0.46) | EGFRMAPTMEN1KMT2AKDM4E | |
| SCHEMBL16274895 | 0.71 | KDM4E (0.46) | EGFRMAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL16274992 | 0.71 | KDM4E (0.46) | EGFRMAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL16274897 | 0.71 | KDM4E (0.45) | EGFRMAPTKDM4EALDH1A1KDR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2810944-A1 | HETEROCYCLIC COMPOUND HAVING ANTI-HIV ACTIVITY | Toyama Chemical Co., Ltd. (JP) | 2014-12-10 | — | — | EP | disclosed |