Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL9094219 | 0.90 | GRIN2B (0.31) | GRIN2B | |
| SCHEMBL16094012 | 0.81 | CYP3A4 (0.31) | CYP3A4GRIN2B | |
| SCHEMBL16099270 | 0.79 | CYP3A4 (0.30) | CYP3A4 | |
| SCHEMBL16099547 | 0.78 | ALDH1A1 (0.31) | ALDH1A1CYP3A4GRIN2B | |
| SCHEMBL9084446 | 0.78 | IDO1 (0.35) | IDO1 | |
| SCHEMBL11451258 | 0.77 | — | — | |
| SCHEMBL9712160 | 0.77 | — | — | |
| SCHEMBL16093941 | 0.77 | ELANE (0.33) | — | |
| SCHEMBL16100069 | 0.76 | CYP3A4 (0.30) | CYP3A4 | |
| Bromide SCHEMBL28967094 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014152718-A1 | SACCHARIDE CONJUGATES | ARIZONA BOARD OF REGENTS, FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2014-09-25 | — | — | WO | disclosed |