Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | RARB | P10826 | 8/20 | 0.41 |
| ▸ | RARG | P13631 | 8/20 | 0.41 |
| ▸ | RARA | P10276 | 7/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL3274235 | 0.78 | RARB (0.56) | RARBRARGRARACYP26A1CYP26B1 | |
| SCHEMBL391979 | 0.73 | KDM4E (1.00) | KDM4EMAPTALDH1A1CYP2C19POLB | |
| SCHEMBL13745377 | 0.73 | KDM4E (1.00) | KDM4EMAPTALDH1A1CYP2C19POLB | |
| SCHEMBL1809924 | 0.73 | KDM4E (1.00) | KDM4EMAPTALDH1A1CYP2C19POLB | |
| SCHEMBL7400117 | 0.71 | KDM4E (0.79) | KDM4EMAPTALDH1A1CYP2C19POLB | |
| SCHEMBL9143255 | 0.69 | RARB (0.57) | RARBRARGRARACYP26A1CYP26B1 | |
| SCHEMBL7402104 | 0.69 | ALDH1A1 (0.54) | KDM4EMAPTALDH1A1CYP2C19POLB | |
| SCHEMBL7400148 | 0.69 | KDM4E (0.54) | KDM4EMAPTALDH1A1CYP2C19POLB | |
| Hydrochloric Acid SCHEMBL9141002 | 0.68 | HTT (0.49) | KDM4EPOLBTDP1KMT2ARARB | |
| SCHEMBL7405059 | 0.68 | KDM4E (0.83) | KDM4EMAPTALDH1A1CYP2C19POLB |
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-1996015099-A1 | HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 1996-05-23 | — | — | WO | disclosed |
| WO-1996015100-A1 | HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 1996-05-23 | — | — | WO | disclosed |