Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 3/20 | 0.52 |
| ▸ | MPO | P05164 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | CTRC | Q99895 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27997631 | 0.84 | ALDH1A1 (0.49) | PDE10A | |
| SCHEMBL7499087 | 0.80 | LTA4H (0.43) | ROCK1MPOBACE1 | |
| SCHEMBL31331676 | 0.80 | ALOX5 (0.53) | MPOALOX5CYP2D6NFKB1TAAR1 | |
| SCHEMBL5249618 | 0.78 | MPO (0.46) | MPOTAAR1 | |
| SCHEMBL5214698 | 0.76 | DHFR (0.63) | MPO | |
| SCHEMBL9829477 | 0.75 | DHFR (0.63) | — | |
| SCHEMBL9536189 | 0.73 | NOS2 (0.47) | ROCK1 | |
| SCHEMBL3906522 | 0.73 | MPO (0.43) | MPOTAAR1 | |
| SCHEMBL9535888 | 0.73 | ALDH1A1 (0.51) | ROCK1MPOCYP2D6PDE10A | |
| SCHEMBL5215491 | 0.73 | F12 (0.53) | CYP2D6TAAR1BACE1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1831170-A1 | SUBSTITUTED AMINOPYRIDINES AND USES THEREOF | AstraZeneca AB (SE) | 2007-09-12 | — | — | EP | disclosed |
| WO-2006065204-A1 | SUBSTITUTED AMINOPYRIDINES AND USES THEREOF | ASTRAZENECA AB (SE) | 2006-06-22 | — | — | WO | disclosed |