Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 7/20 | 0.66 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.53 |
| ▸ | PDE5A | O76074 | 2/20 | 0.51 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL2580717 | 0.89 | SOS1 (0.69) | SOS1PDE5ANPY5RUSP2ALDH1A1 | |
| SCHEMBL2588773 | 0.87 | SOS1 (0.66) | SOS1PDE5ANPY5RUSP2ALDH1A1 | |
| SCHEMBL2587390 | 0.87 | SOS1 (0.66) | SOS1PDE5ANPY5RUSP2ALDH1A1 | |
| SCHEMBL2583209 | 0.85 | SOS1 (0.72) | SOS1PDE5AALDH1A1LMNAMAPT | |
| SCHEMBL2590218 | 0.85 | SOS1 (0.66) | SOS1NTRK1PDE5AALDH1A1LMNA | |
| SCHEMBL2587500 | 0.84 | SLC2A1 (0.65) | SOS1USP2ALDH1A1LMNAMAPT | |
| SCHEMBL2592287 | 0.84 | SOS1 (0.71) | SOS1PDE5ANPY5RALDH1A1LMNA | |
| SCHEMBL2584997 | 0.84 | SOS1 (0.65) | SOS1PDE5ANPY5RALDH1A1LMNA | |
| SCHEMBL2588890 | 0.83 | SOS1 (0.70) | SOS1NTRK1PDE5ANPY5RALDH1A1 | |
| SCHEMBL2588902 | 0.80 | SOS1 (0.66) | SOS1NTRK1PDE5ANPY5RUSP2 |
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-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 |