Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 10/20 | 0.49 |
| ▸ | IDO1 | P14902 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6339714 | 0.79 | APEX1 (0.44) | APEX1IDO1MAPTTDP1LMNA | |
| SCHEMBL8565517 | 0.78 | — | — | |
| Aurantiogliocladin SCHEMBL487583 | 0.70 | MAPT (0.50) | APEX1IDO1MAPTTDP1LMNA | |
| SCHEMBL7324226 | 0.69 | APEX1 (0.45) | APEX1MAPTTDP1LMNACYP3A4 | |
| SCHEMBL6577829 | 0.68 | APEX1 (0.42) | APEX1IDO1MAPTTDP1LMNA | |
| SCHEMBL3755961 | 0.66 | APEX1 (1.00) | APEX1IDO1 | |
| SCHEMBL9655485 | 0.65 | CDC25A (0.64) | APEX1IDO1MAPTTDP1LMNA | |
| SCHEMBL9180312 | 0.65 | DUSP3 (0.48) | APEX1IDO1MAPTTDP1LMNA | |
| SCHEMBL487582 | 0.65 | IDO1 (0.42) | APEX1IDO1MAPTTDP1LMNA | |
| SCHEMBL3754350 | 0.62 | APEX1 (0.74) | APEX1IDO1MAPTTDP1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5789446-A | QUINONE DERIVATIVES OF ALKYLPROPENOIC ACID AS ANTIARTHRITIC AGENTS | EISAI CO., LTD. (JP) | 1998-08-04 | — | — | US | disclosed |