Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 4/20 | 0.35 |
| ▸ | PRKDC | P78527 | 2/20 | 0.35 |
| ▸ | FAAH | O00519 | 6/20 | 0.33 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.32 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.31 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.31 |
| ▸ | ITGAL | P20701 | 2/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.31 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.31 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.31 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.31 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19905490 | 0.94 | PRKDC (0.41) | HPGDSPRKDCFAAHSOS1ITGB2 | |
| SCHEMBL17874743 | 0.94 | PRKDC (0.41) | HPGDSPRKDCFAAHSOS1ITGB2 | |
| SCHEMBL19905336 | 0.91 | PRKDC (0.36) | PRKDCFAAHSOS1ITGB2ICAM1 | |
| SCHEMBL19905298 | 0.90 | PRKDC (0.39) | HPGDSPRKDCFAAHSOS1ITGB2 | |
| SCHEMBL19905167 | 0.90 | HPGDS (0.35) | HPGDSPRKDCFAAHSOS1CDK1 | |
| SCHEMBL17874752 | 0.88 | PRKDC (0.40) | HPGDSPRKDCFAAHSOS1ITGB2 | |
| SCHEMBL19905277 | 0.87 | CDK1 (0.35) | HPGDSPRKDCFAAHSOS1CDK1 | |
| SCHEMBL17874793 | 0.87 | PRKDC (0.42) | PRKDCFAAHITGB2ICAM1ITGAL | |
| SCHEMBL17874725 | 0.86 | PRKDC (0.42) | PRKDCFAAHSOS1EZH2BDKRB1 | |
| SCHEMBL17874786 | 0.86 | PRKDC (0.41) | PRKDCFAAH |
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 |