Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HCAR3 | P49019 | 4/20 | 0.41 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL12800309 | 0.83 | HTT (0.45) | HCAR3MEN1KMT2AMAPTGAA | |
| SCHEMBL5095344 | 0.77 | TP53 (0.50) | TP53CASRTDP1CYP3A4SMN1; SMN2 | |
| SCHEMBL15054482 | 0.77 | MAPT (0.62) | TP53HCAR3CASRTDP1CYP3A4 | |
| SCHEMBL3889343 | 0.77 | TP53 (0.53) | TP53CASRTDP1CYP3A4SMN1; SMN2 | |
| SCHEMBL15054231 | 0.77 | HTT (0.40) | HCAR3TDP1MEN1KMT2AMAPT | |
| Alcohol SCHEMBL28214623 | 0.75 | CYP3A4 (0.55) | TP53CASRTDP1CYP3A4SMN1; SMN2 | |
| Methyl Alcohol SCHEMBL27399292 | 0.73 | CYP3A4 (0.61) | TP53TDP1CYP3A4SMN1; SMN2MEN1 | |
| SCHEMBL132541 | 0.73 | CYP3A4 (0.65) | TP53CASRTDP1CYP3A4SMN1; SMN2 | |
| SCHEMBL29944162 | 0.73 | CYP3A4 (0.65) | TP53CASRTDP1CYP3A4SMN1; SMN2 | |
| SCHEMBL232779 | 0.73 | TP53 (0.64) | TP53CASRTDP1CYP3A4SMN1; SMN2 |
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-2013096151-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2013-06-27 | — | — | WO | disclosed |