Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH2 | P48735 | 8/20 | 0.33 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 0.33 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.30 |
| ▸ | KDM1A | O60341 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | IDH1 | O75874 | 1/20 | 0.30 |
| ▸ | AKT1 | P31749 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19706045 | 0.91 | IDH2 (0.35) | IDH2SPHK2SPHK1RPS6KB1KDM1A | |
| SCHEMBL16249949 | 0.86 | FYN (0.34) | IDH2SPHK2SPHK1RPS6KB1KDM1A | |
| Trifluoroacetic Acid SCHEMBL16238443 | 0.84 | TRPV1 (0.34) | IDH2SPHK2SPHK1RPS6KB1 | |
| SCHEMBL17618334 | 0.83 | TRPV1 (0.36) | IDH2SPHK2SPHK1KDM1AMAOA | |
| SCHEMBL16775772 | 0.80 | FYN (0.37) | KDM1AMAOAMAOB | |
| SCHEMBL16237965 | 0.79 | KMT2A (0.37) | IDH2KDM1AMAOAMAOB | |
| SCHEMBL19365673 | 0.78 | RHOA (0.39) | IDH2RPS6KB1KDM1AMAOAMAOB | |
| SCHEMBL16237553 | 0.76 | FYN (0.37) | IDH2 | |
| SCHEMBL19364920 | 0.76 | IDH2 (0.40) | IDH2KDM1AMAOAMAOB | |
| SCHEMBL19706975 | 0.76 | IDH2 (0.36) | IDH2KDM1AMAOAMAOB |
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 |