Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.69 |
| ▸ | HPGDS | O60760 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | CD38 | P28907 | 2/20 | 0.43 |
| ▸ | JAK2 | O60674 | 2/20 | 0.43 |
| ▸ | JAK1 | P23458 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 2/20 | 0.43 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20273951 | 0.77 | KMT2A (0.47) | IRAK4HSD17B10JAK2KMT2A | |
| SCHEMBL24023125 | 0.72 | IRAK4 (0.42) | IRAK4LMNAALDH1A1CYP3A4MAPK1 | |
| SCHEMBL20051446 | 0.72 | IRAK4 (0.40) | IRAK4ALDH1A1CYP3A4 | |
| SCHEMBL22872840 | 0.72 | LMNA (0.55) | IRAK4LMNAHSD17B10EGFRALDH1A1 | |
| SCHEMBL27504590 | 0.72 | PDE5A (0.58) | HPGDSHSD17B10CD38 | |
| SCHEMBL29118643 | 0.72 | IRAK4 (0.49) | IRAK4LMNAHTTEGFRALDH1A1 | |
| SCHEMBL30748895 | 0.72 | IRAK4 (0.52) | IRAK4LMNAHSD17B10EGFRUSP2 | |
| SCHEMBL3712626 | 0.72 | IRAK4 (0.44) | IRAK4HSD17B10JAK2KMT2A | |
| SCHEMBL21318578 | 0.71 | IRAK4 (0.77) | IRAK4LMNAHSD17B10CD38MEN1 | |
| SCHEMBL22872893 | 0.70 | MAP4K4 (0.49) | HPGDSPKMJAK2JAK1EGFR |
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-2019143678-A1 | DNA-PK INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2019-07-25 | — | — | WO | disclosed |