Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 1/20 | 0.43 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.43 |
| ▸ | PLK1 | P53350 | 6/20 | 0.40 |
| ▸ | PPARD | Q03181 | 3/20 | 0.38 |
| ▸ | SUV39H1 | O43463 | 1/20 | 0.36 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.36 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 3/20 | 0.36 |
| ▸ | PPARA | Q07869 | 3/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | HSPH1 | Q92598 | 1/20 | 0.35 |
| ▸ | PLK3 | Q9H4B4 | 2/20 | 0.35 |
| ▸ | PTGFR | P43088 | 1/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | MTTP | P55157 | 1/20 | 0.34 |
| ▸ | IGF2BP2 | Q9Y6M1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10205546 | 0.94 | NTRK1 (0.42) | NTRK1NTRK2PLK1PPARDSUV39H1 | |
| SCHEMBL402266 | 0.92 | NTRK1 (0.43) | NTRK1NTRK2PLK1PPARDSUV39H1 | |
| SCHEMBL401089 | 0.91 | NTRK1 (0.41) | NTRK1NTRK2PLK1PPARDSUV39H1 | |
| SCHEMBL401283 | 0.91 | NTRK1 (0.40) | NTRK1NTRK2PLK1PPARDSUV39H1 | |
| SCHEMBL5316686 | 0.91 | NTRK1 (0.42) | NTRK1NTRK2PLK1PPARDPPARG | |
| SCHEMBL5316647 | 0.89 | NTRK1 (0.41) | NTRK1NTRK2PLK1PPARDPPARG | |
| Sulfuric Acid SCHEMBL402780 | 0.89 | NTRK1 (0.39) | NTRK1NTRK2PLK1PPARDSUV39H1 | |
| SCHEMBL402484 | 0.89 | NTRK1 (0.40) | NTRK1NTRK2PLK1PPARDSUV39H1 | |
| SCHEMBL5318139 | 0.88 | NTRK1 (0.40) | NTRK1NTRK2PLK1PPARDPPARG | |
| SCHEMBL5318808 | 0.87 | NTRK1 (0.39) | NTRK1NTRK2PLK1PPARDPPARG |
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-1803452-A1 | ESTER DERIVATIVE AND PHARMACEUTICAL USE THEREOF | Japan Tobacco, Inc. (JP) | 2007-07-04 | — | — | EP | claimed |