Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 14/20 | 0.45 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17850362 | 0.93 | P2RX7 (0.39) | P2RX7MAPK1ATMLMNA | |
| SCHEMBL17850365 | 0.84 | ATM (0.46) | P2RX7ATMROCK2ROCK1 | |
| SCHEMBL17850355 | 0.83 | ATM (0.45) | P2RX7ATMROCK2ROCK1 | |
| SCHEMBL17850366 | 0.83 | ATM (0.45) | P2RX7ATMROCK2ROCK1 | |
| SCHEMBL17850358 | 0.83 | LMNA (0.58) | ATMLMNA | |
| SCHEMBL17850360 | 0.79 | P2RX7 (0.43) | P2RX7ATMROCK2ROCK1 | |
| SCHEMBL17850357 | 0.73 | ATM (0.56) | P2RX7ATMLMNAROCK2ROCK1 | |
| SCHEMBL12852300 | 0.72 | ATM (0.57) | P2RX7DGAT1MAPK1ATM | |
| SCHEMBL5798009 | 0.67 | P2RX7 (0.54) | P2RX7MAPK1LMNAHDAC8 | |
| SCHEMBL17850363 | 0.65 | MAPK14 (0.44) | P2RX7ATMROCK2ROCK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3034494-A1 | HETEROCYCLIC INHIBITORS OF NECROPTOSIS | President and Fellows of Harvard College (US) | 2016-06-22 | — | — | EP | disclosed |