Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 3/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | COMT | P21964 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CDC25A | P30304 | 1/20 | 0.34 |
| ▸ | CDC25B | P30305 | 1/20 | 0.34 |
| ▸ | CDC25C | P30307 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 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 | |
|---|---|---|---|---|
| SCHEMBL11268398 | 0.91 | ALDH1A1 (0.41) | ROCK2PPARGPPARDPPARAALDH1A1 | |
| SCHEMBL11273409 | 0.89 | ROCK2 (0.41) | ROCK2PPARGPPARDPPARAFAAH | |
| SCHEMBL11267429 | 0.84 | MAPT (0.41) | PPARGPPARDPPARAMGLLALDH1A1 | |
| SCHEMBL11270269 | 0.82 | SMN1; SMN2 (0.39) | PPARGPPARDPPARAFAAHMGLL | |
| SCHEMBL11264984 | 0.82 | KMT2A (0.39) | PPARGPPARDPPARAMGLLCOMT | |
| SCHEMBL11270609 | 0.82 | HCAR1 (0.36) | ROCK2PPARGPPARDPPARAMGLL | |
| SCHEMBL11278370 | 0.81 | PPARD (0.41) | PPARGPPARDPPARATDP1 | |
| SCHEMBL11269796 | 0.80 | PPARD (0.36) | PPARGPPARDPPARAALDH1A1GRM1 | |
| SCHEMBL11265484 | 0.79 | ALDH1A1 (0.36) | ROCK2PPARGPPARDPPARAALDH1A1 | |
| SCHEMBL11279347 | 0.79 | MAPT (0.47) | PPARGPPARDPPARAMGLLALDH1A1 |
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-4350701-A | 1-(Trihalomethyl-sulfenyl)-4-aryl-1,2,4-triazolin-5-ones, and process for controlling fungi | BASF AKTIENGESELLSCHAFT (DE) | 1982-09-21 | — | — | US | disclosed |