Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.33 |
| ▸ | CA2 | P00918 | 4/20 | 0.33 |
| ▸ | CA9 | Q16790 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | THRB | P10828 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 5/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.33 |
| ▸ | CA12 | O43570 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9058693 | 0.75 | MAPK1 (0.43) | MAPK1ATMCYP1A2CYP2C9CHRM1 | |
| SCHEMBL2902233 | 0.68 | CYP1A2 (0.46) | MAPK1ATMCYP1A2CYP2C9CA1 | |
| SCHEMBL430605 | 0.68 | TNF (0.50) | CYP1A2CYP2C9ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL7984001 | 0.68 | CYP1A2 (0.46) | MAPK1ATMCYP1A2CYP2C9CHRM1 | |
| SCHEMBL22834815 | 0.67 | CYP1A2 (0.47) | CYP1A2CYP2C9KDM4E | |
| SCHEMBL3033366 | 0.67 | ALDH1A1 (0.46) | CYP2C9ALDH1A1GAA | |
| SCHEMBL7998348 | 0.67 | CYP1A2 (0.45) | MAPK1ATMCYP1A2CYP2C9LMNA | |
| SCHEMBL11734584 | 0.66 | CYP1A2 (0.43) | MAPK1CYP1A2CYP2C9CA1CA2 | |
| SCHEMBL9058315 | 0.65 | MKNK1 (0.41) | MAPK1ATMCYP1A2CYP2C9LMNA | |
| SCHEMBL9058562 | 0.65 | ALDH1A1 (0.46) | MAPK1ATMCYP1A2CYP2C9CHRM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996016656-A1 | CONDENSED IMIDAZOLE DERIVATIVES, THEIR PREPARATION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-06-06 | — | — | WO | disclosed |