Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.42 |
| ▸ | PRKCQ | Q04759 | 3/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4379701 | 0.90 | MAPT (0.46) | MAPTSIRT5PRKCQCLK4NPC1 | |
| SCHEMBL4380349 | 0.86 | MAPT (0.55) | MAPTSIRT5PRKCQNPC1RAB9A | |
| SCHEMBL4383230 | 0.84 | SIRT5 (0.59) | MAPTSIRT5ALDH1A1 | |
| SCHEMBL1182313 | 0.84 | SIRT5 (0.59) | MAPTSIRT5ALDH1A1 | |
| SCHEMBL1181753 | 0.83 | SIRT5 (0.48) | MAPTSIRT5PRKCQIDO1TDO2 | |
| SCHEMBL1182432 | 0.82 | SIRT5 (0.59) | MAPTSIRT5TDP1 | |
| SCHEMBL906408 | 0.82 | MAPT (0.49) | MAPTSIRT5RAB9A | |
| SCHEMBL4384924 | 0.81 | MAPT (0.54) | MAPTSIRT5PRKCQSMN1; SMN2IDO1 | |
| SCHEMBL3171667 | 0.80 | MAPT (0.48) | MAPTSIRT5PRKCQCLK4RAB9A | |
| SCHEMBL1182065 | 0.79 | MAPT (0.49) | MAPTSIRT5CLK4ALDH1A1GAA |
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-2066665-A2 | BICYCLIC NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS FOR USE AS STEAROYL COA DESATURASE INHIBITORS | CV THERAPEUTICS, INC. (US) | 2009-06-10 | — | — | EP | disclosed |
| WO-2008043087-A2 | BICYCLIC NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS FOR USE AS STEAROYL COA DESATURASE INHIBITORS | CV THERAPEUTICS, INC. (US) | 2008-04-10 | — | — | WO | disclosed |