Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATP1A1 | P05023 | 12/20 | 0.92 |
| ▸ | ATP1B1 | P05026 | 12/20 | 0.92 |
| ▸ | ATP1A3 | P13637 | 12/20 | 0.92 |
| ▸ | ATP1B2 | P14415 | 12/20 | 0.92 |
| ▸ | ATP1A2 | P50993 | 12/20 | 0.92 |
| ▸ | ATP1B3 | P54709 | 12/20 | 0.92 |
| ▸ | FXYD2 | P54710 | 12/20 | 0.92 |
| ▸ | ATP1A4 | Q13733 | 12/20 | 0.92 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.69 |
| ▸ | TP53 | P04637 | 3/20 | 0.69 |
| ▸ | LMNA | P02545 | 2/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.69 |
| ▸ | HBB | P68871 | 1/20 | 0.69 |
| ▸ | NPC1 | O15118 | 2/20 | 0.65 |
| ▸ | RAB9A | P51151 | 2/20 | 0.65 |
| ▸ | MAPT | P10636 | 2/20 | 0.64 |
| ▸ | USP2 | O75604 | 1/20 | 0.62 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.62 |
| ▸ | STAT3 | P40763 | 1/20 | 0.62 |
| ▸ | SLCO4C1 | Q6ZQN7 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| Digitoxigenin Gentiobioside SCHEMBL702464 | 1.00 | ATP1A1 (0.92) | ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2 | |
| Uzarin SCHEMBL702463 | 1.00 | ATP1A1 (0.92) | ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2 | |
| Desglucouzarin SCHEMBL30615298 | 0.96 | ATP1A1 (1.00) | ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2 | |
| Thevetin B SCHEMBL869661 | 0.93 | ATP1A1 (0.80) | ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2 | |
| Thevetin B SCHEMBL29463277 | 0.93 | ATP1A1 (0.80) | ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2 | |
| Thevetin B SCHEMBL29389027 | 0.93 | ATP1A1 (0.80) | ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2 | |
| Thevetin B SCHEMBL12556692 | 0.93 | ATP1A1 (0.80) | ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2 | |
| SCHEMBL29413165 | 0.93 | ATP1A1 (0.79) | ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2 | |
| SCHEMBL31655532 | 0.91 | ATP1A1 (0.91) | ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2 | |
| SCHEMBL31135096 | 0.91 | ATP1A1 (0.91) | ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7927613-B2 | Pharmaceutical co-crystal compositions | UNIVERSITY OF SOUTH FLORIDA (US) | 2011-04-19 | — | — | US | disclosed |
| US-7790905-B2 | Pharmaceutical propylene glycol solvate compositions | MCNEIL-PPC, INC. (US) | 2010-09-07 | — | — | US | disclosed |