Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.33 |
| ▸ | ATP1A1 | P05023 | 1/20 | 0.30 |
| ▸ | ATP1B1 | P05026 | 1/20 | 0.30 |
| ▸ | ATP1A3 | P13637 | 1/20 | 0.30 |
| ▸ | ATP1B2 | P14415 | 1/20 | 0.30 |
| ▸ | ATP1A2 | P50993 | 1/20 | 0.30 |
| ▸ | ATP1B3 | P54709 | 1/20 | 0.30 |
| ▸ | FXYD2 | P54710 | 1/20 | 0.30 |
| ▸ | ATP1A4 | Q13733 | 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 | |
|---|---|---|---|---|
| SCHEMBL7338815 | 0.82 | HTT (0.43) | — | |
| SCHEMBL7337662 | 0.80 | LTA4H (0.44) | NR1H4 | |
| SCHEMBL7340278 | 0.79 | NR1H4 (0.34) | NR1H4 | |
| SCHEMBL7344129 | 0.79 | NR1H4 (0.33) | NR1H4 | |
| SCHEMBL7346567 | 0.78 | LTA4H (0.40) | — | |
| SCHEMBL7345511 | 0.78 | NR1H4 (0.33) | NR1H4 | |
| SCHEMBL7339136 | 0.78 | NR1H4 (0.33) | NR1H4 | |
| SCHEMBL7339312 | 0.77 | NR1H4 (0.34) | NR1H4ATP1A1ATP1B1ATP1A3ATP1B2 | |
| SCHEMBL7340174 | 0.76 | LTA4H (0.35) | NR1H4 | |
| Oxalic Acid SCHEMBL7347292 | 0.75 | LTA4H (0.40) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0578080-B1 | 3,9-disubstituted-spiro (5.5)undecanes active on the cardiovascular system, process for their preparation and pharmaceutical composition containing same | SIGMA TAU IND FARMACEUTI (IT) | 1997-04-23 | — | — | EP | claimed |