Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4575642 | 0.85 | TDP1 (0.56) | TDP1ALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL63068 | 0.82 | TDP1 (0.67) | TDP1ALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL20548409 | 0.79 | ALDH1A1 (0.64) | TDP1ALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL8330361 | 0.79 | TDP1 (0.52) | TDP1ALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL19244224 | 0.78 | TDP1 (0.76) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL19244223 | 0.78 | TDP1 (0.76) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL2531606 | 0.78 | TDP1 (0.65) | TDP1ALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL18123566 | 0.77 | TDP1 (0.61) | TDP1ALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL17576317 | 0.77 | TDP1 (0.61) | TDP1ALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL13078900 | 0.77 | TDP1 (0.61) | TDP1ALDH1A1CYP3A4CA2LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1871735-A1 | ANTIOXIDANTS | Merck Patent GmbH (DE) | 2008-01-02 | — | — | EP | disclosed |
| WO-2006111233-A1 | ANTIOXIDANTS | MERCK PATENT GMBH (DE) | 2006-10-26 | — | — | WO | disclosed |