Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8081420 | 0.90 | LMNA (0.41) | MAPTTP53SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL8089352 | 0.81 | SMN1; SMN2 (0.39) | MAPTTP53SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL8081430 | 0.81 | PTK2 (0.41) | TP53SMN1; SMN2KDM4EALDH1A1TSHR | |
| SCHEMBL1004434 | 0.70 | TSHR (0.40) | SMN1; SMN2KDM4EALDH1A1TSHRSLC6A2 | |
| SCHEMBL1006811 | 0.69 | KDM4A (0.37) | — | |
| SCHEMBL7682599 | 0.64 | PTGES (0.47) | MAPTSMN1; SMN2ALDH1A1LMNATSHR | |
| SCHEMBL7678604 | 0.64 | PTGES (0.47) | MAPTTP53SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL8088618 | 0.63 | MEN1 (0.45) | MAPTTP53SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL13844718 | 0.62 | SMN1; SMN2 (0.53) | MAPTSMN1; SMN2KDM4EALDH1A1LMNA | |
| SCHEMBL7049001 | 0.61 | SMN1; SMN2 (0.45) | MAPTTP53SMN1; SMN2KDM4EALDH1A1 |
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-1054667-A1 | BICYCLIC PYRROLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTIINFLAMMATORY AND IMMUNOMODULATING AGENTS | AstraZeneca UK Limited (GB) | 2000-11-29 | — | — | EP | disclosed |
| WO-1999040913-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA UK LIMITED (GB) | 1999-08-19 | — | — | WO | disclosed |