Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TYMP | P19971 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL8664564 | 1.00 | CES2 (0.43) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL8666744 | 0.78 | CES2 (0.63) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL8666745 | 0.78 | CES2 (0.63) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL15761173 | 0.77 | CES2 (0.47) | CES2CES1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL6630643 | 0.77 | NPC1 (0.50) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL14395308 | 0.77 | NPC1 (0.50) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL31080818 | 0.77 | NPC1 (0.50) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL10441889 | 0.76 | CES2 (0.54) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL17842362 | 0.72 | CES2 (0.52) | CES2CES1GAAALDH1A1ALOX15 | |
| SCHEMBL10441874 | 0.71 | KDM4E (0.49) | CES2CES1GAAALDH1A1ALOX15 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5786374-A | FUNGICIDES, MICROBIOCIDES | NOVARTIS CORPORATION (US) | 1998-07-28 | — | — | US | disclosed |
| WO-1996014305-A1 | BENZISOXAZOLE DERIVATIVES AND PESTICIDAL COMPOSITIONS CONTAINING THEM | NOVARTIS AG (CH) | 1996-05-17 | — | — | WO | disclosed |