Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.39 |
| ▸ | DDT | P30046 | 3/20 | 0.39 |
| ▸ | GLS | O94925 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | HPGD | P15428 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MLYCD | O95822 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5246799 | 0.95 | PSEN1 (0.41) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL5248109 | 0.95 | EGLN1 (0.38) | NAMPTPSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5244376 | 0.93 | PSEN1 (0.41) | NAMPTPSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5246995 | 0.91 | DDT (0.41) | NAMPTPSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5244307 | 0.90 | DDT (0.50) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL5246077 | 0.90 | MMP13 (0.37) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL3111267 | 0.90 | GLS (0.43) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL5245221 | 0.88 | HPGD (0.44) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL5246041 | 0.88 | MIF (0.45) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL5247824 | 0.87 | MMP13 (0.39) | PSEN1PSEN2APH1BNCSTNAPH1A |
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 |