Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | TNF | P01375 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL480361 | 0.73 | MAPT (0.50) | ADORA2BMAPTKDM4ELMNAHTT | |
| SCHEMBL30799164 | 0.67 | ADORA2B (0.43) | ADORA2BMAPTKDM4ELMNAGLA | |
| SCHEMBL10562805 | 0.62 | — | — | |
| SCHEMBL316763 | 0.61 | ADORA2B (1.00) | ADORA2BMAPTLMNAGLABLM | |
| SCHEMBL9409708 | 0.60 | ADORA2B (0.42) | ADORA2BGLABLMADORA3KMT2A | |
| SCHEMBL29620659 | 0.60 | ALDH1A1 (0.34) | MAPT | |
| SCHEMBL11480035 | 0.59 | KDM4E (0.50) | ADORA2BMAPTKDM4ELMNAHTT | |
| SCHEMBL2256402 | 0.59 | MAPT (0.55) | MAPTKDM4ELMNAHTTNPSR1 | |
| SCHEMBL29042327 | 0.59 | MAPT (0.55) | MAPTKDM4ELMNAHTTNPSR1 | |
| SCHEMBL15804011 | 0.59 | MAPT (0.55) | MAPTKDM4ELMNAHTTNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024050825-A1 | COMPOUNDS AS MLKL INHIBITORS | NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) | 2024-03-14 | — | — | WO | disclosed |