Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.45 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.45 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.45 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | IDH1 | O75874 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10915647 | 0.86 | IDH1 (0.52) | KMT2AKCNQ3KCNQ2EPHX2LMNA | |
| SCHEMBL27600106 | 0.84 | HDAC1 (0.47) | KCNQ3KCNQ2KCNQ4KCNQ5POLB | |
| SCHEMBL10914147 | 0.83 | ALDH3A1 (0.48) | KMT2ALMNAL3MBTL1ALDH1A1MAPT | |
| SCHEMBL2106687 | 0.78 | LMNA (0.60) | KMT2AEPHX2POLBLMNAL3MBTL1 | |
| SCHEMBL3369250 | 0.78 | LMNA (0.60) | KMT2AEPHX2POLBLMNAL3MBTL1 | |
| SCHEMBL10487619 | 0.78 | LMNA (0.60) | KMT2AEPHX2POLBLMNAL3MBTL1 | |
| SCHEMBL11316917 | 0.77 | EPHX2 (0.56) | KMT2AEPHX2POLBLMNAL3MBTL1 | |
| SCHEMBL658139 | 0.76 | LMNA (0.60) | KMT2AEPHX2POLBLMNAL3MBTL1 | |
| SCHEMBL11467043 | 0.75 | AKR1C3 (0.43) | KMT2APOLBLMNAL3MBTL1ALDH1A1 | |
| SCHEMBL10879122 | 0.75 | LMNA (0.56) | KMT2AEPHX2LMNAL3MBTL1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0107216-B1 | HETEROCYCLIC COMPOUNDS, THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND METHOD OF CONTROLLING UNWANTED PLANT GROWTH | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1986-10-01 | — | — | EP | disclosed |
| US-4452626-A | Herbicidal 4-(benzotriazol-1-yl)phenoxy)alkanoic acids, esters and salts | SHELL OIL COMPANY (US) | 1984-06-05 | — | — | US | disclosed |
| EP-0107216-A1 | Heterocyclic compounds, their preparation, compositions containing them and method of controlling unwanted plant growth | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1984-05-02 | — | — | EP | disclosed |