Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.39 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8555774 | 0.89 | CYP11B1 (0.42) | CYP11B1CYP11B2SMN1; SMN2LTB4RLTB4R2 | |
| SCHEMBL8109544 | 0.86 | SMN1; SMN2 (0.44) | SMN1; SMN2CYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8551523 | 0.84 | CYP17A1 (0.47) | SMN1; SMN2HSD17B10CYP3A4HPGDLMNA | |
| SCHEMBL7772046 | 0.83 | SLC6A4 (0.42) | SMN1; SMN2CYP3A4HPGDLMNATDP1 | |
| SCHEMBL7773934 | 0.83 | SLC6A4 (0.42) | SMN1; SMN2CYP3A4HPGDLMNATDP1 | |
| SCHEMBL8551073 | 0.82 | MAPK1 (0.47) | SMN1; SMN2PPARGPPARAMAPK1CYP2C19 | |
| SCHEMBL8552624 | 0.81 | CYP19A1 (0.47) | CYP11B1CYP11B2SMN1; SMN2CYP2D6CYP3A4 | |
| SCHEMBL8133883 | 0.80 | CYP17A1 (0.40) | SMN1; SMN2CYP2D6CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8550969 | 0.79 | EPHX1 (0.46) | SMN1; SMN2 | |
| SCHEMBL8555652 | 0.78 | PPARG (0.41) | CYP11B1CYP11B2SMN1; SMN2PPARGPPARA |
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-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 |