Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5974020 | 0.79 | RXFP1 (0.36) | TDP1 | |
| SCHEMBL31284444 | 0.79 | NQO2 (0.36) | TDP1 | |
| SCHEMBL21642455 | 0.76 | TDP1 (0.31) | TDP1 | |
| SCHEMBL405679 | 0.70 | TDP1 (0.41) | TDP1PIK3R1PIK3CA | |
| SCHEMBL7467279 | 0.69 | TDP1 (0.32) | TDP1 | |
| SCHEMBL29162274 | 0.68 | CYP3A4 (0.39) | TDP1 | |
| SCHEMBL31399981 | 0.68 | KDM4E (0.57) | TDP1 | |
| SCHEMBL118875 | 0.68 | KDM4E (0.57) | TDP1 | |
| SCHEMBL18032481 | 0.67 | HTR2A (0.32) | — | |
| SCHEMBL405383 | 0.67 | KMT2A (0.39) | TDP1 |
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-108191778-B | Method for preparing 2, 3-dichloro quinoxaline derivative by one-pot boiling | 重庆医科大学 | 2021-03-02 | — | — | CN | disclosed |