Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 3/20 | 0.39 |
| ▸ | NOS2 | P35228 | 3/20 | 0.39 |
| ▸ | NOS3 | P29474 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18849326 | 0.71 | ALDH1A1 (0.37) | ALDH1A1NOS1NOS2NOS3 | |
| SCHEMBL914963 | 0.68 | — | — | |
| SCHEMBL31274350 | 0.68 | ALDH1A1 (0.58) | ALDH1A1 | |
| SCHEMBL2978856 | 0.68 | ALDH1A1 (0.58) | ALDH1A1 | |
| SCHEMBL2978854 | 0.68 | ALDH1A1 (0.58) | ALDH1A1 | |
| SCHEMBL25426745 | 0.68 | — | — | |
| SCHEMBL475136 | 0.68 | — | — | |
| SCHEMBL48866 | 0.67 | ALDH1A1 (0.89) | ALDH1A1NOS1NOS2 | |
| SCHEMBL2278796 | 0.67 | ALDH1A1 (0.89) | ALDH1A1NOS1NOS2 | |
| SCHEMBL22284066 | 0.67 | ALDH1A1 (0.89) | ALDH1A1NOS1NOS2 |
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-2017078403-A1 | A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2017-05-11 | — | — | WO | disclosed |