Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 14/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20215235 | 0.91 | P2RX7 (0.47) | P2RX7KDM4EALDH1A1NOTUMDPP4 | |
| SCHEMBL20215263 | 0.89 | P2RX7 (0.46) | P2RX7KDM4EALDH1A1 | |
| SCHEMBL20215228 | 0.88 | P2RX7 (0.42) | P2RX7NOTUMDPP4DPP8 | |
| SCHEMBL20215246 | 0.88 | PPARG (0.37) | P2RX7KDM4EALDH1A1NOTUM | |
| SCHEMBL20215219 | 0.88 | P2RX7 (0.41) | P2RX7ALDH1A1NOTUMDPP4DPP8 | |
| SCHEMBL20215214 | 0.87 | P2RX7 (0.50) | P2RX7KDM4EALDH1A1 | |
| SCHEMBL20215265 | 0.86 | ALDH1A1 (0.40) | P2RX7ALDH1A1 | |
| SCHEMBL20215269 | 0.85 | P2RX7 (0.40) | P2RX7NOTUM | |
| SCHEMBL20215248 | 0.85 | P2RX7 (0.39) | P2RX7KDM4ENOTUMDPP4DPP8 | |
| SCHEMBL20215275 | 0.84 | P2RX7 (0.44) | P2RX7KDM4EALDH1A1 |
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 |