Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL8552624 | 0.95 | CYP19A1 (0.47) | SMN1; SMN2KCNA5CYP17A1CYP2C9CYP2C19 | |
| SCHEMBL8133883 | 0.90 | CYP17A1 (0.40) | SMN1; SMN2KCNA5CYP17A1CYP2C9CYP2C19 | |
| SCHEMBL8550969 | 0.89 | EPHX1 (0.46) | SMN1; SMN2KCNA5ADRB1ADRB3KCNH2 | |
| SCHEMBL8552459 | 0.88 | CYP17A1 (0.44) | CYP17A1CYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL7983312 | 0.88 | SMN1; SMN2 (0.42) | SMN1; SMN2KCNA5CYP17A1CYP2C9CYP2C19 | |
| SCHEMBL8553465 | 0.88 | SMN1; SMN2 (0.42) | SMN1; SMN2KCNA5CYP17A1CYP2C9CYP2C19 | |
| SCHEMBL8118264 | 0.87 | DGAT2 (0.39) | KCNA5CYP17A1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL8118689 | 0.87 | KCNA5 (0.48) | SMN1; SMN2KCNA5CYP17A1CYP2C9CYP2C19 | |
| SCHEMBL8118468 | 0.87 | KCNA5 (0.45) | KCNA5CYP17A1CYP3A4CYP19A1ADRB1 | |
| SCHEMBL8123208 | 0.87 | MKNK1 (0.46) | SMN1; SMN2CYP17A1CYP2C9CYP2C19CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1037889-A1 | NOVEL COMPOUNDS | AstraZeneca UK Limited (GB) | 2000-09-27 | — | — | EP | disclosed |
| WO-1999029686-A1 | NOVEL COMPOUNDS | ASTRAZENECA UK LIMITED (GB) | 1999-06-17 | — | — | WO | disclosed |
| EP-0865431-A2 | COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 1998-09-23 | — | — | EP | disclosed |
| WO-1997020815-A1 | COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1997-06-12 | — | — | WO | disclosed |