Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8565866 | 0.85 | CYP19A1 (0.33) | CYP3A4SMN1; SMN2CYP19A1POLBHTT | |
| SCHEMBL8565855 | 0.84 | POLB (0.33) | CYP3A4SMN1; SMN2CYP19A1POLBHTT | |
| SCHEMBL8078887 | 0.80 | POLB (0.41) | SMN1; SMN2CYP19A1POLBHTTMAPT | |
| SCHEMBL5973535 | 0.80 | POLB (0.41) | CYP19A1POLBHTTBACE1MAPT | |
| SCHEMBL8078889 | 0.77 | HTT (0.39) | SMN1; SMN2CYP19A1POLBHTTMAPT | |
| SCHEMBL5973317 | 0.77 | NQO2 (0.40) | CYP19A1POLBHTTMAPTKMT2A | |
| SCHEMBL8090408 | 0.76 | KMT2A (0.41) | SMN1; SMN2MAPTKMT2APKMALDH1A1 | |
| SCHEMBL8086955 | 0.75 | TRPV1 (0.37) | SMN1; SMN2POLBMAPTKMT2AALDH1A1 | |
| SCHEMBL27462958 | 0.75 | GRK6 (0.37) | POLBMAPTKMT2APKMALDH1A1 | |
| SCHEMBL27440732 | 0.75 | NQO2 (0.38) | SMN1; SMN2CYP19A1POLBHTTMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0853617-A1 | NOVEL 2,3-DIOXO-1,2,3,4-TETRAHYDRO-QUINOYXALINYL DERIVATIVES | Novartis AG (CH) | 1998-07-22 | — | — | EP | disclosed |
| WO-1997008155-A1 | NOVEL 2,3-DIOXO-1,2,3,4-TETRAHYDRO-QUINOYXALINYL DERIVATIVES | NOVARTIS AG (CH) | 1997-03-06 | — | — | WO | disclosed |