Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | TPH1 | P17752 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4349354 | 1.00 | LDHA (0.53) | LDHASLC6A4CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL14860143 | 0.85 | EPHX1 (0.48) | EPHX1ALDH1A1HTT | |
| SCHEMBL14860145 | 0.85 | EPHX1 (0.48) | EPHX1ALDH1A1HTT | |
| SCHEMBL1527219 | 0.85 | EPHX1 (0.48) | EPHX1ALDH1A1HTT | |
| SCHEMBL3777016 | 0.85 | LDHA (0.52) | LDHASLC6A4CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL4343817 | 0.84 | RIPK1 (0.40) | TDP1EPHX1TPH1 | |
| SCHEMBL4343822 | 0.84 | RIPK1 (0.40) | TDP1EPHX1TPH1 | |
| SCHEMBL4359730 | 0.84 | SLC6A4 (0.50) | SLC6A4CYP1A2CYP2D6CYP2C19PPARG | |
| SCHEMBL4359724 | 0.84 | SLC6A4 (0.50) | SLC6A4CYP1A2CYP2D6CYP2C19PPARG | |
| SCHEMBL4347700 | 0.82 | ANPEP (0.40) | CYP1A2CYP2C19ALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2070928-A1 | 7-azaindol-3-ylacrylamides active as kinase inhibitors | NERVIANO MEDICAL SCIENCES S.r.l. (IT) | 2009-06-17 | — | — | EP | disclosed |