Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | TYR | P14679 | 2/20 | 0.41 |
| ▸ | GCGR | P47871 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10025403 | 0.81 | KCNH2 (0.46) | KCNH2GCGRTDP1TP53CYP3A4 | |
| SCHEMBL834352 | 0.80 | KDM4E (0.45) | TDP1TP53MEN1KMT2AL3MBTL1 | |
| SCHEMBL27813430 | 0.78 | TYR (0.47) | KCNH2TYRTDP1TP53CYP3A4 | |
| SCHEMBL28858991 | 0.76 | KCNH2 (0.53) | KCNH2TYRGCGRTDP1TP53 | |
| Bromide SCHEMBL28825154 | 0.75 | TYR (0.45) | KCNH2TYRTDP1TP53CYP3A4 | |
| SCHEMBL24609039 | 0.73 | TLR8 (0.53) | TYR | |
| SCHEMBL23205753 | 0.71 | PSMB5 (0.37) | TDP1KDM4EALDH1A1 | |
| SCHEMBL28876834 | 0.71 | TDP1 (0.47) | KCNH2TDP1L3MBTL1LIPGLMNA | |
| SCHEMBL28219671 | 0.71 | TDP1 (0.47) | KCNH2TDP1L3MBTL1LIPGLMNA | |
| SCHEMBL28293306 | 0.71 | TYR (0.56) | KCNH2TYRTDP1TP53CYP3A4 |
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-2018047109-A1 | POLYCYCLIC PYRIDONE COMPOUNDS AS ANTIVIRALS | NOVARTIS AG (CH) | 2018-03-15 | — | — | WO | disclosed |