Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.41 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.38 |
| ▸ | STING1 | Q86WV6 | 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 | |
|---|---|---|---|---|
| SCHEMBL5247403 | 0.94 | LMNA (0.39) | ROCK2ROCK1ALDH1A1CCR1 | |
| SCHEMBL5249047 | 0.88 | LMNA (0.38) | ROCK2ROCK1ALDH1A1MAPTCCR1 | |
| SCHEMBL5250067 | 0.86 | P2RX7 (0.39) | P2RX7METALDH1A1MAPTCCR1 | |
| SCHEMBL5247254 | 0.86 | HPGD (0.44) | ROCK2ALDH1A1 | |
| SCHEMBL5244114 | 0.84 | CCR1 (0.43) | ALDH1A1MAPTCCR1 | |
| SCHEMBL5244366 | 0.82 | CCR1 (0.45) | ROCK2ALDH1A1MAPTCCR1 | |
| SCHEMBL5247031 | 0.82 | LMNA (0.41) | P2RX7METALDH1A1 | |
| SCHEMBL5246361 | 0.82 | CCR1 (0.49) | ROCK2MAPTCCR1 | |
| SCHEMBL5244456 | 0.82 | LMNA (0.57) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL5244694 | 0.82 | HPGD (0.48) | ROCK2ROCK1ALDH1A1MAPTSMN1; 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 |
|---|---|---|---|---|---|---|---|
| EP-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |