Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 6/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.43 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.43 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9216896 | 0.92 | RPS6KA2 (0.48) | RPS6KA2ALDH1A1HPGDSMN1; SMN2HTT | |
| SCHEMBL6513151 | 0.82 | CES1 (0.52) | KMT2AMEN1POLBCASP1RPS6KA2 | |
| SCHEMBL13750463 | 0.78 | GAA (0.61) | KMT2AMEN1POLBCASP1ALDH1A1 | |
| SCHEMBL13698953 | 0.77 | ACHE (0.57) | KMT2AMEN1ALDH1A1HPGDMAPT | |
| SCHEMBL9214156 | 0.76 | ALDH1A1 (0.41) | KMT2AMEN1RPS6KA2ALDH1A1HPGD | |
| SCHEMBL3455773 | 0.73 | RPS6KA2 (0.65) | KMT2AMEN1RPS6KA2ALDH1A1HPGD | |
| SCHEMBL1296639 | 0.73 | ACHE (0.64) | KMT2AMEN1ALDH1A1HPGDMAPT | |
| SCHEMBL31180742 | 0.72 | MEN1 (0.62) | KMT2AMEN1POLBCASP1ALDH1A1 | |
| SCHEMBL19796124 | 0.72 | MAPT (0.46) | ALDH1A1MAPT | |
| SCHEMBL9218494 | 0.71 | ACHE (0.66) | ACHE |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2180879-A | — | — | None | — | — | JP | disclosed |
| EP-0369526-B1 | Nitromethylene compounds, their preparation and their use as pesticides | SHELL INT RESEARCH (NL) | 1995-07-26 | — | — | EP | disclosed |
| US-5039686-A | Insecticides | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1991-08-13 | — | — | US | disclosed |
| JP-H02180879-A | NITROMETHYLENE COMPOUND AND ITS PRODUCTION, ITS USE AS AGROCHEMICAL | SHELL INTERNATL RES MAATSCHAPPIJ BV | 1990-07-13 | — | — | JP | disclosed |
| EP-0369526-A2 | Nitromethylene compounds, their preparation and their use as pesticides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1990-05-23 | — | — | EP | disclosed |