Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | BLM | P54132 | 1/20 | 0.58 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.54 |
| ▸ | RAD52 | P43351 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7403597 | 0.88 | KDM4E (0.69) | KDM4EMAPTCYP2C19ALDH1A1POLB | |
| SCHEMBL7400117 | 0.81 | KDM4E (0.79) | KDM4EMAPTCYP2C19ALDH1A1POLB | |
| SCHEMBL197942 | 0.79 | KDM4E (0.61) | KDM4EMAPTCYP2C19ALDH1A1POLB | |
| SCHEMBL197941 | 0.79 | KDM4E (0.61) | KDM4EMAPTCYP2C19ALDH1A1POLB | |
| SCHEMBL29380732 | 0.79 | KDM4E (0.61) | KDM4EMAPTCYP2C19ALDH1A1POLB | |
| SCHEMBL197940 | 0.79 | KDM4E (0.61) | KDM4EMAPTCYP2C19ALDH1A1POLB | |
| SCHEMBL7402146 | 0.78 | KDM4E (0.52) | KDM4EMAPTCYP2C19ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL17604963 | 0.77 | KDM4E (0.59) | KDM4EMAPTCYP2C19ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL4835592 | 0.77 | KDM4E (0.59) | KDM4EMAPTCYP2C19ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL4835584 | 0.77 | KDM4E (0.59) | KDM4EMAPTCYP2C19ALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996015100-A1 | HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 1996-05-23 | — | — | WO | claimed |
| WO-1996015100-A1 | HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 1996-05-23 | — | — | WO | disclosed |