Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | DNA2 | P51530 | 1/20 | 0.48 |
| ▸ | CASP6 | P55212 | 1/20 | 0.48 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.45 |
| ▸ | CLK1 | P49759 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.42 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6537493 | 0.81 | ALDH1A1 (0.58) | ALDH1A1TDP1DNA2CASP6CTDSP1 | |
| SCHEMBL259909 | 0.75 | TDP1 (0.54) | ALDH1A1TDP1DNA2CASP6CTDSP1 | |
| SCHEMBL6090060 | 0.71 | DNA2 (0.56) | ALDH1A1TDP1DNA2CASP6CTDSP1 | |
| SCHEMBL28312938 | 0.71 | MAPT (0.57) | ALDH1A1TDP1DNA2CASP6CTDSP1 | |
| SCHEMBL29236598 | 0.71 | DNA2 (0.56) | ALDH1A1TDP1DNA2CASP6CTDSP1 | |
| SCHEMBL1017079 | 0.71 | DNA2 (0.56) | ALDH1A1TDP1DNA2CASP6CTDSP1 | |
| SCHEMBL30275708 | 0.71 | DNA2 (0.56) | ALDH1A1TDP1DNA2CASP6CTDSP1 | |
| SCHEMBL28027350 | 0.69 | TDP1 (0.73) | ALDH1A1TDP1MAPTMAPK1PARP1 | |
| SCHEMBL8602787 | 0.69 | MAPT (0.55) | ALDH1A1MAPTCYP1A2TSHRHPGD | |
| SCHEMBL11003986 | 0.69 | TDP1 (0.48) | ALDH1A1TDP1DNA2CASP6CTDSP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5773449-A | BACTERICIDES FOR HELICOBACTER | ZENYAKU KOGYO KABUSHIKI KAISHA (JP) | 1998-06-30 | — | — | US | disclosed |
| EP-0786454-A1 | THIOQUINOLONE DERIVATIVE | ZENYAKU KOGYO KABUSHIKIKAISHA (JP) | 1997-07-30 | — | — | EP | disclosed |