Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | SCN1A | P35498 | 1/20 | 0.30 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.30 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2894352 | 0.98 | HSP90AA1 (0.40) | HSP90AA1P2RX7CYP2D6SLC6A4CYP19A1 | |
| SCHEMBL11813334 | 0.80 | CYP2D6 (0.41) | HSP90AA1P2RX7CYP2D6CYP19A1ALDH1A1 | |
| SCHEMBL3717840 | 0.78 | HSP90AA1 (0.40) | HSP90AA1P2RX7CYP19A1 | |
| SCHEMBL5669611 | 0.78 | P2RX7 (0.43) | HSP90AA1P2RX7CYP19A1 | |
| SCHEMBL10042014 | 0.78 | HSP90AA1 (0.38) | HSP90AA1P2RX7CYP2D6CYP19A1ALDH1A1 | |
| SCHEMBL24554448 | 0.76 | HSP90AA1 (0.37) | HSP90AA1P2RX7CYP2D6CYP19A1ALDH1A1 | |
| SCHEMBL12059428 | 0.76 | HSP90AA1 (0.37) | HSP90AA1P2RX7CYP2D6CYP19A1ALDH1A1 | |
| SCHEMBL1890998 | 0.76 | HSP90AA1 (0.37) | HSP90AA1P2RX7CYP2D6CYP19A1ALDH1A1 | |
| SCHEMBL13104790 | 0.76 | HSP90AA1 (0.37) | HSP90AA1P2RX7CYP2D6CYP19A1ALDH1A1 | |
| SCHEMBL26695870 | 0.76 | HSP90AA1 (0.38) | HSP90AA1P2RX7CYP19A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010131145-A1 | CYCLOBUTENEDIONE DERIVATIVES | PFIZER LIMITED (GB) | 2010-11-18 | — | — | WO | disclosed |
| WO-2010131146-A1 | CYCLOBUTENEDIONE DERIVATIVES | PFIZER LIMITED (GB) | 2010-11-18 | — | — | WO | disclosed |
| WO-2010131147-A1 | CYCLOBUTENEDIONE DERIVATIVES | PFIZER LIMITED (GB) | 2010-11-18 | — | — | WO | disclosed |