Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | GRK2 | P25098 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11328752 | 0.92 | KCNH2 (0.39) | PTGESALDH1A1ROCK2GRK2MAPT | |
| SCHEMBL11336736 | 0.90 | PTGES (0.47) | PTGESALDH1A1MAPTLMNATP53 | |
| SCHEMBL11330928 | 0.85 | PTGES (0.43) | PTGESALDH1A1HTTMAPTSMN1; SMN2 | |
| SCHEMBL11324731 | 0.84 | PTGES (0.43) | PTGESALDH1A1NLRP3HTTMAPT | |
| SCHEMBL11334278 | 0.83 | PTGES (0.47) | PTGESALDH1A1HTTMAPTSMN1; SMN2 | |
| SCHEMBL11321450 | 0.80 | PTGES (0.49) | PTGESALDH1A1MAPTSMN1; SMN2LMNA | |
| SCHEMBL11323777 | 0.77 | GAA (0.39) | PTGESALDH1A1ROCK2GRK2MAPT | |
| SCHEMBL11326314 | 0.77 | PTGES (0.46) | PTGESLMNATP53 | |
| SCHEMBL11325851 | 0.77 | KCNH2 (0.40) | PTGESALDH1A1SMN1; SMN2ALOX12KCNH2 | |
| SCHEMBL11326369 | 0.75 | KMT2A (0.44) | PTGESALDH1A1NLRP3HTTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4267338-A | INTERMEDIATES IN THE PRODUCTION OF N-AZOLYLALKYL-HALOGENOACETANILIDE HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1981-05-12 | — | — | US | disclosed |
| EP-0003540-B1 | N-AZOLYLALKYL ANILINES AND PROCESS FOR THEIR PREPARATION | BAYER AG (DE) | 1980-10-01 | — | — | EP | disclosed |
| EP-0003540-A2 | N-azolylalkyl anilines and process for their preparation | BAYER AG (DE) | 1979-08-22 | — | — | EP | disclosed |