Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6705582 | 0.79 | ACHE (0.38) | CYP2C9CYP2C19MAPTALDH1A1 | |
| SCHEMBL15349953 | 0.76 | ALDH1A1 (0.45) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL15349954 | 0.76 | ALDH1A1 (0.45) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL16807837 | 0.75 | CYP1A2 (0.40) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL15349838 | 0.73 | CA4 (0.52) | SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL15349836 | 0.73 | CA4 (0.52) | SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL11807547 | 0.72 | CA1 (0.50) | CYP1A2MAPTPDCD1CD274SMN1; SMN2 | |
| SCHEMBL11807539 | 0.72 | CA1 (0.50) | CYP1A2MAPTPDCD1CD274SMN1; SMN2 | |
| SCHEMBL15349973 | 0.71 | CYP1A2 (0.40) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL15349971 | 0.71 | CYP1A2 (0.40) | CYP1A2GAACYP2C9PKMCYP2C19 |
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-1114029-A1 | NOVEL COMPOUNDS | AstraZeneca AB (SE) | 2001-07-11 | — | — | EP | disclosed |
| WO-2000015614-A1 | NOVEL COMPOUNDS | ASTRAZENECA AB (SE) | 2000-03-23 | — | — | WO | disclosed |