Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | AAK1 | Q2M2I8 | 10/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 7/20 | 0.39 |
| ▸ | IMPDH1 | P20839 | 3/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL6920562 | 0.76 | NOTUM (0.49) | NOTUMAAK1IMPDH2IMPDH1LTA4H | |
| SCHEMBL6920127 | 0.76 | NOTUM (0.49) | NOTUMAAK1IMPDH2IMPDH1LTA4H | |
| SCHEMBL6819640 | 0.75 | PIEZO1 (0.38) | — | |
| SCHEMBL6818762 | 0.71 | NOS3 (0.40) | — | |
| SCHEMBL6822871 | 0.71 | IDO1 (0.32) | — | |
| SCHEMBL5605178 | 0.70 | IDO1 (0.53) | — | |
| SCHEMBL6816069 | 0.69 | ENPP2 (0.35) | — | |
| SCHEMBL14143141 | 0.69 | NOTUM (0.55) | NOTUMIMPDH2IMPDH1LTA4H | |
| SCHEMBL16497034 | 0.68 | PYCR1 (0.43) | — | |
| SCHEMBL30702221 | 0.68 | NOTUM (0.53) | NOTUMAAK1IMPDH2IMPDH1LTA4H |
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-2004032834-A2 | THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2004-04-22 | — | — | WO | disclosed |