Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 15/20 | 0.47 |
| ▸ | PRKDC | P78527 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19905489 | 0.91 | FAAH (0.48) | FAAHPRKDCALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL19905365 | 0.89 | PRKDC (0.41) | FAAHPRKDC | |
| SCHEMBL19905481 | 0.88 | PRKDC (0.40) | FAAHPRKDCCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL19905491 | 0.87 | PRKDC (0.44) | FAAHPRKDCMAPT | |
| SCHEMBL19905441 | 0.86 | PRKDC (0.44) | FAAHPRKDCALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL19905294 | 0.85 | ABL1 (0.40) | FAAHPRKDCALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL15328493 | 0.82 | PRKDC (0.49) | FAAHPRKDCALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL15328500 | 0.82 | PRKDC (0.49) | FAAHPRKDCALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL19905258 | 0.82 | PRKDC (0.37) | FAAHPRKDCMAPT | |
| SCHEMBL17634923 | 0.81 | PRKDC (0.58) | FAAHPRKDCALDH1A1CYP1A2HSD17B10 |
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-3057959-B1 | DNA-PK INHIBITORS | VERTEX PHARMA (US) | 2018-02-28 | — | — | EP | disclosed |