Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.41 |
| ▸ | SRC | P12931 | 3/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | RARG | P13631 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PMM2 | O15305 | 1/20 | 0.36 |
| ▸ | MPI | P34949 | 1/20 | 0.36 |
| ▸ | PHOSPHO1 | Q8TCT1 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL365789 | 0.87 | EGFR (0.41) | EGFRSRCAGTR1KDM4EALDH1A1 | |
| SCHEMBL366821 | 0.87 | AGTR1 (0.41) | EGFRSRCAGTR1KDM4EALDH1A1 | |
| SCHEMBL366034 | 0.84 | ATM (0.41) | EGFRSRCAGTR1KDM4EALDH1A1 | |
| SCHEMBL367256 | 0.83 | EGFR (0.40) | EGFRSRCAGTR1KDM4EALDH1A1 | |
| SCHEMBL365213 | 0.80 | PKM (0.39) | EGFRSRCALDH1A1MEN1KMT2A | |
| SCHEMBL367205 | 0.79 | EGFR (0.45) | EGFRSRCAGTR1KDM4EALDH1A1 | |
| SCHEMBL365023 | 0.78 | EGFR (0.40) | EGFRSRCAGTR1KDM4EALDH1A1 | |
| SCHEMBL367222 | 0.75 | EGFR (0.41) | EGFRSRCPOLBCYP3A4TDP1 | |
| SCHEMBL366116 | 0.72 | CA1 (0.41) | EGFRAGTR1 | |
| SCHEMBL365176 | 0.72 | ATM (0.45) | KDM4EALDH1A1HPGDPOLBMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | claimed |
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |