Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FBP1 | P09467 | 3/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | EIF4E | P06730 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ARNT | P27540 | 1/20 | 0.36 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28186236 | 0.82 | MEN1 (0.40) | TDP1IDO1TDO2EIF4EMAPT | |
| SCHEMBL28185546 | 0.82 | SCN2A (0.44) | FBP1TDP1EIF4ENOTUMMAPT | |
| SCHEMBL28853166 | 0.81 | PTGS2 (0.49) | ATMTDP1HSPB1IDO1TDO2 | |
| SCHEMBL7918730 | 0.81 | ABCC1 (0.49) | TDP1IDO1MAPTMEN1KMT2A | |
| SCHEMBL28185537 | 0.79 | NPC1 (0.53) | FBP1TDP1TDO2MAPTMEN1 | |
| SCHEMBL8529578 | 0.75 | PDE10A (0.47) | FBP1ATMTDP1HSPB1IDO1 | |
| SCHEMBL4785470 | 0.73 | IDO1 (0.53) | IDO1TDO2ARNTEPAS1MEN1 | |
| SCHEMBL2332272 | 0.73 | TDP1 (0.65) | FBP1ATMTDP1HSPB1EIF4E | |
| SCHEMBL28185540 | 0.73 | NPC1 (0.40) | ATMTDP1HTR7HSPB1IDO1 | |
| SCHEMBL28185578 | 0.72 | IDO1 (0.40) | TDP1IDO1TDO2MAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107382892-A | A kind of preparation technology of the nitro isoxazole compound of 3 aryl 4 | 贵州大学 | 2017-11-24 | — | — | CN | disclosed |