Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MARK3 | P27448 | 1/20 | 0.42 |
| ▸ | ULK1 | O75385 | 4/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13373544 | 0.81 | ROCK2 (0.49) | ROCK2GABRA5NAMPTACACB | |
| SCHEMBL18281350 | 0.80 | ALDH1A1 (0.41) | ROCK2NAMPTACACBALDH1A1HTT | |
| SCHEMBL18281318 | 0.78 | THRB (0.49) | ROCK2NAMPTACACBALDH1A1HTT | |
| SCHEMBL1608977 | 0.77 | ROCK2 (0.47) | ROCK2NAMPTACACB | |
| SCHEMBL1085922 | 0.77 | ALDH1A1 (0.41) | ROCK2ACACBALDH1A1HTT | |
| SCHEMBL4553269 | 0.76 | ACACB (0.46) | ROCK2GABRA5NAMPTACACBALDH1A1 | |
| SCHEMBL4650850 | 0.75 | NAMPT (0.43) | ULK1LMNALOXL2GABRA5NAMPT | |
| SCHEMBL13373398 | 0.75 | MMP13 (0.45) | ROCK2ACACBALDH1A1HTT | |
| SCHEMBL4882240 | 0.74 | MAPK14 (0.59) | ROCK2NAMPTL3MBTL1 | |
| SCHEMBL4882259 | 0.74 | MLYCD (0.59) | ROCK2ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4326714-A1 | HETEROCYCLIC COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2024-02-28 | — | — | EP | disclosed |
| WO-2022223750-A1 | HETEROCYCLIC COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2022-10-27 | — | — | WO | disclosed |
| WO-2015134171-A1 | HETEROARYLAMIDE INHIBITORS OF TBK1 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2015-09-11 | — | — | WO | disclosed |