Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6829951 | 0.95 | LCK (0.39) | LCKCYP1A2MAPK1TSHRKDM4E | |
| SCHEMBL150669 | 0.81 | MAPK1 (0.58) | LCKCYP1A2MAPK1TSHRALDH1A1 | |
| Edetol SCHEMBL48412 | 0.77 | TSHR (0.39) | TSHRKDM4EALDH1A1TDP1RECQL | |
| Edetol SCHEMBL2803498 | 0.77 | TSHR (0.39) | TSHRKDM4EALDH1A1TDP1RECQL | |
| SCHEMBL98701 | 0.75 | TSHR (0.40) | TSHRKDM4EALDH1A1TDP1RECQL | |
| SCHEMBL6260966 | 0.75 | KDM4E (0.38) | TSHRKDM4EALDH1A1TDP1RECQL | |
| SCHEMBL9785645 | 0.75 | KDM4E (0.38) | TSHRKDM4EALDH1A1TDP1RECQL | |
| Edetol SCHEMBL8989695 | 0.75 | KDM4E (0.38) | TSHRKDM4EALDH1A1TDP1RECQL | |
| Edetol SCHEMBL20942798 | 0.75 | KDM4E (0.38) | TSHRKDM4EALDH1A1TDP1RECQL | |
| Edetol SCHEMBL3634484 | 0.75 | KDM4E (0.38) | TSHRKDM4EALDH1A1TDP1RECQL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0025142-B1 | POLYQUATERNARY AMMONIUM COMPOUNDS, THEIR PREPARATION, THEIR USE IN PAPER MANUFACTURING AND PAPER TREATING AGENTS CONTAINING THEM | BAYER AG (DE) | 1984-08-08 | — | — | EP | disclosed |
| US-4423194-A | IMIDATION OF COPOLYMERS OF MALEIC ANHYDRIDE AND AN OLEFIN WITH AN AMINE | BAYER AKTIENGESELLSCHAFT (DE) | 1983-12-27 | — | — | US | disclosed |
| EP-0025142-A1 | Polyquaternary ammonium compounds, their preparation, their use in paper manufacturing and paper treating agents containing them | BAYER AG (DE) | 1981-03-18 | — | — | EP | disclosed |