Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 4/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | DDT | P30046 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | GLS | O94925 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 2/20 | 0.40 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.40 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.40 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.40 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.40 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.40 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5244706 | 0.94 | ROCK2 (0.40) | ROCK2ROCK1DDTBRD4PSEN1 | |
| SCHEMBL5246401 | 0.92 | BRD4 (0.41) | POLBMAPTBRD4PSEN1PSEN2 | |
| SCHEMBL5247632 | 0.92 | GLS (0.42) | ROCK2ROCK1POLBDDTGAA | |
| SCHEMBL5246767 | 0.92 | MIF (0.47) | DDTGAAGLSBRD4PSEN1 | |
| SCHEMBL5247497 | 0.92 | PSEN1 (0.45) | ROCK2ROCK1POLBDDTCNR1 | |
| SCHEMBL5246030 | 0.92 | LMNA (0.42) | ROCK2ROCK1POLBDDTMAPT | |
| SCHEMBL5246245 | 0.92 | ROCK2 (0.41) | ROCK2ROCK1DDTMMP13BRD4 | |
| SCHEMBL5244462 | 0.91 | MAPT (0.40) | GAAMAPTMMP13BRD4TP53 | |
| SCHEMBL3111267 | 0.91 | GLS (0.43) | ROCK2ROCK1POLBDDTGLS | |
| SCHEMBL5244747 | 0.91 | BRD4 (0.47) | ROCK2ROCK1DDTGLSMMP13 |
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 |