Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS12 | P56730 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 2/20 | 0.32 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.32 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.32 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.32 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.32 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.32 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.31 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.31 |
| ▸ | SCD | O00767 | 2/20 | 0.31 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5245554 | 0.92 | GABRA5 (0.36) | PRSS12TP53MAPTHDAC8EPHX2 | |
| SCHEMBL5248284 | 0.90 | NPSR1 (0.37) | PRSS12HDAC8BRD4MIFSCD | |
| SCHEMBL5246245 | 0.84 | ROCK2 (0.41) | BRD4PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5247626 | 0.83 | MIF (0.48) | TP53MAPTMIF | |
| SCHEMBL5244299 | 0.83 | BRD4 (0.35) | BRD4PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5247693 | 0.82 | LOX (0.40) | PRSS12MAPTBRD4MIFKLKB1 | |
| SCHEMBL5244638 | 0.82 | LMNA (0.39) | MAPTBRD4ROCK2ROCK1SCD | |
| SCHEMBL5247657 | 0.82 | LMNA (0.46) | HDAC8BRD4MIFEPHX2 | |
| SCHEMBL5248700 | 0.81 | ROCK2 (0.41) | MAPTBRD4MIFROCK2ROCK1 | |
| SCHEMBL5244706 | 0.81 | ROCK2 (0.40) | TP53BRD4PSEN1PSEN2APH1B |
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 |