Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 7/20 | 0.84 |
| ▸ | PDE5A | O76074 | 3/20 | 0.64 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.64 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | EGFR | P00533 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | FADS1 | O60427 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.58 |
| ▸ | LCK | P06239 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2590759 | 0.96 | NPY5R (0.76) | NPY5RPDE5AABCG2SOS1KDM4E | |
| SCHEMBL8890555 | 0.92 | NPY5R (1.00) | NPY5RPDE5AABCG2KDM4ENPC1 | |
| SCHEMBL2592190 | 0.91 | NPY5R (0.78) | NPY5RPDE5AABCG2SOS1KDM4E | |
| Hydrochloric Acid SCHEMBL8901136 | 0.90 | NPY5R (0.97) | NPY5RPDE5AABCG2KDM4ENPC1 | |
| SCHEMBL8892229 | 0.90 | NPY5R (0.97) | NPY5RPDE5AABCG2KDM4ENPC1 | |
| Hydrochloric Acid SCHEMBL8890165 | 0.89 | NPY5R (0.94) | NPY5RPDE5AABCG2KDM4ENPC1 | |
| SCHEMBL2584929 | 0.88 | NPY5R (0.80) | NPY5RPDE5AABCG2KDM4ENPC1 | |
| SCHEMBL2588890 | 0.84 | SOS1 (0.70) | NPY5RPDE5ASOS1KDM4EALDH1A1 | |
| SCHEMBL3581297 | 0.83 | ULK1 (0.59) | NPY5RPDE5AABCG2SOS1KDM4E | |
| SCHEMBL2591063 | 0.83 | NPY5R (1.00) | NPY5RPDE5AABCG2NPC1RAB9A |
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 |