Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SNCA | P37840 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | LPO | P22079 | 3/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | CMA1 | P23946 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28267508 | 0.81 | LMNA (0.48) | PKMLPOSIGMAR1CMA1KDM4E | |
| SCHEMBL17913024 | 0.77 | PKM (0.67) | PKMSIGMAR1CMA1KDM4EALDH1A1 | |
| SCHEMBL17912900 | 0.74 | TP53 (0.48) | SNCAPKMLPOCMA1LMNA | |
| SCHEMBL19643644 | 0.74 | ROCK2 (0.60) | PKMKDM4EALDH1A1GAA | |
| SCHEMBL19643226 | 0.74 | ROCK2 (0.59) | TP53MAPT | |
| SCHEMBL14858045 | 0.71 | MEN1 (0.60) | SNCALPOSIGMAR1CMA1KDM4E | |
| SCHEMBL29801659 | 0.71 | MEN1 (0.60) | SNCALPOSIGMAR1CMA1KDM4E | |
| SCHEMBL17129418 | 0.70 | MAOB (0.58) | SNCAMEN1KMT2A | |
| SCHEMBL3933655 | 0.70 | IDO1 (0.47) | SNCA | |
| SCHEMBL28868418 | 0.68 | LMNA (0.46) | PKMLPOSIGMAR1CMA1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3464262-A1 | TRIAZOLONES AND TETRAZOLONES AS INHIBITORS OF ROCK | Bristol-Myers Squibb Company (US) | 2019-04-10 | — | — | EP | disclosed |
| WO-2017205709-A1 | TRIAZOLONES AND TETRAZOLONES AS INHIBITORS OF ROCK | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-11-30 | — | — | WO | disclosed |