Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 2/20 | 0.66 |
| ▸ | PDE5A | O76074 | 4/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | APP | P05067 | 1/20 | 0.56 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.55 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.55 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.55 |
| ▸ | MERTK | Q12866 | 1/20 | 0.55 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | XBP1 | P17861 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | RAD52 | P43351 | 1/20 | 0.54 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2588890 | 0.92 | SOS1 (0.70) | SOS1PDE5AMAPTKMT2ALMNA | |
| SCHEMBL2583209 | 0.92 | SOS1 (0.72) | SOS1PDE5AMAPTKMT2ALMNA | |
| SCHEMBL2584997 | 0.90 | SOS1 (0.65) | SOS1PDE5AMAPTKMT2ALMNA | |
| SCHEMBL2588902 | 0.89 | SOS1 (0.66) | SOS1PDE5AMAPTKMT2ALMNA | |
| SCHEMBL2587225 | 0.89 | SOS1 (0.66) | SOS1PDE5AMAPTKMT2ALMNA | |
| SCHEMBL2592287 | 0.89 | SOS1 (0.71) | SOS1PDE5AMAPTKMT2ALMNA | |
| SCHEMBL2590586 | 0.86 | SLC2A1 (0.73) | SOS1PDE5ALMNAAPPCTNNB1 | |
| SCHEMBL4738601 | 0.86 | RAD52 (0.62) | SOS1PDE5AMAPTKMT2ALMNA | |
| SCHEMBL2583780 | 0.85 | PDE5A (0.67) | PDE5AMAPTKMT2ALMNAMEN1 | |
| SCHEMBL2590962 | 0.85 | SOS1 (0.66) | SOS1PDE5AMAPTKMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2566480-A2 | METHODS AND COMPOSITIONS FOR INHIBITION OF THE TRANSITIONAL ENDOPLASMIC RETICULUM ATPASE | California Institute of Technology (US) | 2013-03-13 | — | — | EP | disclosed |
| WO-2011140527-A2 | METHODS AND COMPOSITIONS FOR INHIBITION OF THE TRANSITIONAL ENDOPLASMIC RETICULUM ATPASE | CALIFORNIA INSTITUTE OF TECHNOLOGY AND THE UNIVERSITY OF KANSAS (US) | 2011-11-10 | — | — | WO | disclosed |
| WO-2011140527-A2 | METHODS AND COMPOSITIONS FOR INHIBITION OF THE TRANSITIONAL ENDOPLASMIC RETICULUM ATPASE | CALIFORNIA INSTITUTE OF TECHNOLOGY AND THE UNIVERSITY OF KANSAS (US) | 2011-11-10 | — | — | WO | disclosed |