Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 9/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | MAPT | P10636 | 6/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.54 |
| ▸ | HPGD | P15428 | 5/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | BCHE | P06276 | 4/20 | 0.54 |
| ▸ | ACHE | P22303 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.54 |
| ▸ | TP53 | P04637 | 3/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.54 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL8312603 | 0.99 | TDP1 (0.55) | TDP1ALDH1A1MAPTSMN1; SMN2HPGD | |
| Sulfuric Acid SCHEMBL8315215 | 0.95 | TDP1 (0.50) | TDP1ALDH1A1MAPTSMN1; SMN2HPGD | |
| Sulfuric Acid SCHEMBL8315218 | 0.93 | TDP1 (0.51) | TDP1ALDH1A1MAPTSMN1; SMN2HPGD | |
| SCHEMBL8709235 | 0.92 | TDP1 (0.56) | TDP1ALDH1A1MAPTSMN1; SMN2HPGD | |
| SCHEMBL8311408 | 0.91 | TDP1 (0.57) | TDP1ALDH1A1MAPTSMN1; SMN2HPGD | |
| Hydrochloric Acid SCHEMBL8316789 | 0.90 | ALDH1A1 (0.58) | TDP1ALDH1A1MAPTSMN1; SMN2HPGD | |
| Sulfuric Acid SCHEMBL8317545 | 0.87 | TDP1 (0.52) | TDP1ALDH1A1MAPTSMN1; SMN2HPGD | |
| Sulfuric Acid SCHEMBL8317546 | 0.85 | TDP1 (0.52) | TDP1ALDH1A1MAPTSMN1; SMN2HPGD | |
| Fagaridine SCHEMBL8711761 | 0.84 | ALDH1A1 (0.76) | TDP1ALDH1A1MAPTSMN1; SMN2HPGD | |
| Fagaridine SCHEMBL108986 | 0.83 | ALDH1A1 (0.77) | TDP1ALDH1A1MAPTSMN1; SMN2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5747502-A | ANTITUMOR AGENTS, ANTIGROWTH AGENTS AND ANTICARCINOGENIC AGENTS | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1998-05-05 | — | — | US | claimed |