Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Tropolone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DBH | P09172 | 3/20 | 0.73 |
| ▸ | MMP2 | P08253 | 1/20 | 0.73 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA4 | P22748 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Tropolone SCHEMBL42739 | 0.85 | — | — | |
| Tropolone SCHEMBL9643338 | 0.83 | DBH (0.94) | DBHMMP2HDAC4HDAC2HDAC8 | |
| Tropolone SCHEMBL16910519 | 0.83 | DBH (0.94) | DBHMMP2HDAC4HDAC2HDAC8 | |
| Tropolone SCHEMBL5969452 | 0.83 | DBH (0.94) | DBHMMP2HDAC4HDAC2HDAC8 | |
| Tropolone SCHEMBL9644286 | 0.83 | DBH (0.94) | DBHMMP2HDAC4HDAC2HDAC8 | |
| Tropolone SCHEMBL531387 | 0.83 | DBH (0.94) | DBHMMP2HDAC4HDAC2HDAC8 | |
| Tropolone SCHEMBL9643396 | 0.83 | DBH (0.94) | DBHMMP2HDAC4HDAC2HDAC8 | |
| Tropolone SCHEMBL9644163 | 0.83 | DBH (0.94) | DBHMMP2HDAC4HDAC2HDAC8 | |
| Tropolone SCHEMBL29029471 | 0.83 | DBH (0.94) | DBHMMP2HDAC4HDAC2HDAC8 | |
| Tropolone SCHEMBL9643137 | 0.83 | DBH (0.94) | DBHMMP2HDAC4HDAC2HDAC8 |
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-2598208-A2 | NEW USES | Evocutis plc (GB) | 2013-06-05 | — | — | EP | disclosed |
| WO-2012013967-A2 | NEW USES | SYNTOPIX GROUP PLC (GB) | 2012-02-02 | — | — | WO | disclosed |