Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.46 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.46 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11266950 | 0.88 | MAPT (0.69) | MAPTNPSR1POLBMAPK1KDM4E | |
| SCHEMBL11264549 | 0.85 | PTGS2 (0.59) | MAPTNPSR1POLBMAPK1KDM4E | |
| SCHEMBL656776 | 0.81 | PTGS2 (0.66) | MAPTNPSR1POLBPTGS2KMT2A | |
| SCHEMBL11260473 | 0.79 | MAPK1 (0.65) | MAPTNPSR1POLBMAPK1KDM4E | |
| SCHEMBL9188865 | 0.77 | PTGS2 (0.61) | MAPTNPSR1KDM4EPTGS2KMT2A | |
| SCHEMBL11421528 | 0.77 | MAPT (0.52) | MAPTNPSR1POLBMAPK1KDM4E | |
| SCHEMBL13215131 | 0.77 | POLB (0.52) | MAPTNPSR1POLBMAPK1KDM4E | |
| SCHEMBL3535207 | 0.77 | MAPT (0.60) | MAPTNPSR1POLBMAPK1TDP1 | |
| SCHEMBL14533446 | 0.75 | PTGS2 (0.59) | MAPTNPSR1POLBKDM4EPTGS2 | |
| SCHEMBL14506304 | 0.75 | PTGS2 (0.78) | MAPTNPSR1PTGS2KMT2AGAA |
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-4323691-A | Hydroxyaminomethyl derivatives of benzoyl di-substituted α-phenoxyalkanoyl esters | ABBOTT LABORATORIES (US) | 1982-04-06 | — | — | US | disclosed |