Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.57 |
| ▸ | RRM2 | P31350 | 7/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | NCOA3 | Q9Y6Q9 | 3/20 | 0.45 |
| ▸ | NCOA1 | Q15788 | 2/20 | 0.45 |
| ▸ | RRM1 | P23921 | 1/20 | 0.45 |
| ▸ | RRM2B | Q7LG56 | 1/20 | 0.45 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TOP2A | P11388 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8685397 | 0.82 | RRM2 (0.45) | MAOARRM2KDM4ENCOA3NCOA1 | |
| SCHEMBL4336886 | 0.73 | MAOA (1.00) | MAOAKDM4ENPC1RAB9AMAPT | |
| SCHEMBL293101 | 0.73 | TOP2A (0.68) | RRM2NCOA3RRM1RRM2BCISD1 | |
| SCHEMBL4336882 | 0.73 | MAOA (1.00) | MAOAKDM4ENPC1RAB9AMAPT | |
| SCHEMBL534248 | 0.73 | TOP2A (0.68) | RRM2NCOA3RRM1RRM2BCISD1 | |
| SCHEMBL8683198 | 0.71 | RRM2 (0.43) | RRM2KDM4ENCOA3NCOA1RRM1 | |
| SCHEMBL8683949 | 0.70 | RRM2 (0.44) | RRM2KDM4ENCOA3NCOA1RRM1 | |
| SCHEMBL17835729 | 0.70 | POLB (0.59) | MAOAKDM4EPOLB | |
| SCHEMBL17835730 | 0.70 | POLB (0.59) | MAOAKDM4EPOLB | |
| SCHEMBL27999265 | 0.70 | MAOA (0.91) | MAOAKDM4ENPC1RAB9AMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5721259-A | Method of using 2-formylpyridine thiosemicarbazone compounds | YALE UNIVERSITY (US) | 1998-02-24 | — | — | US | disclosed |
| EP-0570294-B1 | 2-Formylpyridine thiosemicarbazone derivatives, their preparation and their use as antitumor agents | UNIV YALE (US) | 1997-07-30 | — | — | EP | disclosed |
| US-5281715-A | 2-formylpyridine thiosemicarbazone compounds | YALE UNIVERSITY (US) | 1994-01-25 | — | — | US | disclosed |
| EP-0570294-A1 | 2-Formylpyridine thiosemicarbazone derivatives, their preparation and their use as antitumor agents | YALE UNIVERSITY (US) | 1993-11-18 | — | — | EP | disclosed |