Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 5/20 | 0.40 |
| ▸ | AR | P10275 | 5/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | C5AR1 | P21730 | 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 | |
|---|---|---|---|---|
| SCHEMBL20215235 | 0.88 | P2RX7 (0.47) | P2RX7ALDH1A1KDM4EC5AR1 | |
| SCHEMBL20215263 | 0.86 | P2RX7 (0.46) | P2RX7ALDH1A1MAPTSMN1; SMN2KDM4E | |
| SCHEMBL20215228 | 0.85 | P2RX7 (0.42) | P2RX7MAPT | |
| SCHEMBL20215214 | 0.84 | P2RX7 (0.50) | P2RX7ALDH1A1MAPTKDM4E | |
| SCHEMBL20215243 | 0.84 | P2RX7 (0.42) | P2RX7ALDH1A1KDM4E | |
| SCHEMBL20215227 | 0.83 | CYP11B1 (0.39) | ARCTSSCTSKALDH1A1KDM4E | |
| SCHEMBL20215219 | 0.82 | P2RX7 (0.41) | P2RX7ALDH1A1MAPT | |
| SCHEMBL20215269 | 0.82 | P2RX7 (0.40) | P2RX7 | |
| SCHEMBL20215226 | 0.82 | L3MBTL1 (0.49) | P2RX7CTSSCTSKALDH1A1GRIN1 | |
| SCHEMBL20215236 | 0.82 | P2RX7 (0.40) | 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 |