Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 18/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20215285 | 0.91 | P2RX7 (0.57) | P2RX7KDM4EALDH1A1GAAATM | |
| SCHEMBL20215286 | 0.89 | P2RX7 (0.55) | P2RX7KDM4EALDH1A1GAAATM | |
| SCHEMBL20215277 | 0.86 | P2RX7 (0.71) | P2RX7 | |
| SCHEMBL20215354 | 0.85 | P2RX7 (0.52) | P2RX7KDM4EALDH1A1GAAATM | |
| SCHEMBL20215355 | 0.84 | P2RX7 (0.59) | P2RX7 | |
| SCHEMBL20215352 | 0.82 | P2RX7 (0.56) | P2RX7 | |
| SCHEMBL20216065 | 0.80 | P2RX7 (0.54) | P2RX7 | |
| SCHEMBL20215304 | 0.80 | P2RX7 (0.51) | P2RX7 | |
| SCHEMBL20215362 | 0.80 | P2RX7 (0.62) | P2RX7 | |
| SCHEMBL20215350 | 0.79 | P2RX7 (0.61) | P2RX7 |
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 |
|---|---|---|---|---|---|---|---|
| US-9988373-B2 | Nitrogen-containing six-membered cyclic derivatives and pharmaceutical composition comprising the same | SHIONOGI & CO., LTD. (JP) | 2018-06-05 | — | — | US | disclosed |
| US-9988373-B2 | Nitrogen-containing six-membered cyclic derivatives and pharmaceutical composition comprising the same | SHIONOGI & CO., LTD. (JP) | 2018-06-05 | — | — | US | disclosed |