Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 2/20 | 0.39 |
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | PPARA | Q07869 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12438055 | 0.86 | TRPA1 (0.47) | TRPA1CYP11B2CYP11B1SMN1; SMN2NPC1 | |
| SCHEMBL6518724 | 0.82 | CES2 (0.57) | ALDH1A1KMT2ACES2CES1 | |
| SCHEMBL1922201 | 0.82 | SMN1; SMN2 (0.55) | SMN1; SMN2NPC1RAB9AALDH1A1GAA | |
| SCHEMBL8545021 | 0.81 | FLT1 (0.45) | SMN1; SMN2NPC1RAB9AALDH1A1GAA | |
| Bromide SCHEMBL2097705 | 0.81 | CES2 (0.56) | ALDH1A1KMT2ACES2CES1 | |
| SCHEMBL4110083 | 0.81 | DGAT1 (0.58) | SMN1; SMN2NPC1RAB9AALDH1A1GAA | |
| SCHEMBL8395051 | 0.81 | FLT1 (0.45) | CYP11B2SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL29993431 | 0.81 | DGAT1 (0.58) | SMN1; SMN2NPC1RAB9AALDH1A1GAA | |
| SCHEMBL27439106 | 0.79 | ABL1 (0.56) | SMN1; SMN2RAB9AALDH1A1GAAKMT2A | |
| SCHEMBL29712852 | 0.79 | ALDH1A1 (0.55) | SMN1; SMN2RAB9AALDH1A1LMNAHPGD |
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-6103667-A | Phenylpyrazole herbicides | NOVARTIS CORPORATION (US) | 2000-08-15 | — | — | US | disclosed |
| EP-0832070-A1 | NOVEL HERBICIDES | Novartis AG (CH) | 1998-04-01 | — | — | EP | disclosed |
| WO-1997000246-A1 | NOVEL HERBICIDES | NOVARTIS AG (CH) | 1997-01-03 | — | — | WO | disclosed |