Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH2 | P48735 | 8/20 | 0.35 |
| ▸ | CNR2 | P34972 | 3/20 | 0.35 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.32 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19670570 | 0.92 | IDH2 (0.36) | IDH2CNR2CNR1ROCK2RPS6KB1 | |
| SCHEMBL19670197 | 0.86 | CNR2 (0.35) | IDH2CNR2CNR1KDM1AMAPT | |
| SCHEMBL19670568 | 0.86 | IDH2 (0.38) | IDH2CNR2CNR1RPS6KB1MAPT | |
| SCHEMBL19670330 | 0.84 | IDH2 (0.36) | IDH2CNR2CNR1MAPT | |
| SCHEMBL19670326 | 0.83 | SCN9A (0.35) | IDH2CNR2CNR1 | |
| SCHEMBL19670210 | 0.82 | CNR2 (0.36) | IDH2CNR2CNR1KDM1APIM2 | |
| SCHEMBL17618375 | 0.81 | IDH2 (0.39) | IDH2ROCK2RPS6KB1MAPTPIM2 | |
| SCHEMBL17618357 | 0.76 | RPS6KB1 (0.39) | IDH2RPS6KB1KDM1AMAPTMEN1 | |
| SCHEMBL17618374 | 0.74 | IDH2 (0.40) | IDH2ROCK2RPS6KB1PIM2 | |
| SCHEMBL17624591 | 0.71 | IDH2 (0.42) | IDH2MAPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |