Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TXNRD1 | Q16881 | 14/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27257375 | 0.84 | RORC (0.39) | TXNRD1S1PR1RORCCA12CA1 | |
| Nitroanilide SCHEMBL9528964 | 0.84 | RORC (0.36) | TXNRD1S1PR4MAPTS1PR1MAPK1 | |
| SCHEMBL9637992 | 0.81 | TXNRD1 (0.41) | TXNRD1S1PR4MAPTS1PR1MAPK1 | |
| SCHEMBL9531761 | 0.74 | TXNRD1 (0.36) | TXNRD1S1PR4MAPTS1PR1MAPK1 | |
| SCHEMBL9528691 | 0.73 | HCRTR1 (0.36) | TXNRD1 | |
| SCHEMBL9526332 | 0.67 | RORC (0.39) | RORC | |
| SCHEMBL31749121 | 0.65 | TXNRD1 (0.40) | TXNRD1S1PR4MAPTS1PR1MAPK1 | |
| SCHEMBL31749086 | 0.63 | HCRTR1 (0.36) | — | |
| SCHEMBL28347460 | 0.62 | ALDH1A1 (0.43) | CA12CA2CA9 | |
| 2-Nitroaniline SCHEMBL29396517 | 0.62 | PDE7A (0.62) | MAPTMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0417875-B1 | 1-METHOXYPYRIMIDINYL-1H-1,2,4-TRIAZOLE-3-SULFONIC ACID NITROANILIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS AGENTS WITH HERBICIDAL ACTIVITY | SCHERING AKTIENGESELLSCHAFT (DE) | 1993-05-12 | — | — | EP | claimed |