Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 14/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.50 |
| ▸ | AKT2 | P31751 | 2/20 | 0.47 |
| ▸ | CTSV | O60911 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.43 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL934607 | 0.78 | EPHX2 (0.51) | — | |
| SCHEMBL13737919 | 0.77 | GRIN2D (0.56) | ROCK2ROCK1AKT2CTSVCTSL | |
| SCHEMBL933474 | 0.77 | PRKCI (0.57) | ROCK2 | |
| SCHEMBL952139 | 0.77 | CD74 (0.54) | CTSVCTSLCTSBCTSS | |
| SCHEMBL951716 | 0.76 | CTSV (0.52) | ROCK2ROCK1CTSVCTSLCTSB | |
| SCHEMBL5218911 | 0.74 | TBXAS1 (0.55) | — | |
| SCHEMBL22501830 | 0.74 | ROCK2 (0.59) | ROCK2ROCK1CTSVCTSLCTSB | |
| SCHEMBL6037977 | 0.74 | MAPT (0.54) | — | |
| SCHEMBL3663278 | 0.74 | CCNT1 (0.52) | ROCK2ROCK1AKT2CHEK1AKT1 | |
| SCHEMBL19837880 | 0.73 | CHEK1 (0.50) | ROCK2ROCK1CHEK1 |
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-2011006935-A2 | TETRAZOLE DERIVATIVES | MERCK SERONO S.A. (CH) | 2011-01-20 | — | — | WO | disclosed |