Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 2/20 | 0.31 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16653951 | 0.99 | NOS1 (0.35) | NOS1NOS2BACE1RAPGEF4 | |
| SCHEMBL14830125 | 0.97 | NOS1 (0.34) | NOS1NOS2BACE1RAPGEF4 | |
| Hydrochloric Acid SCHEMBL3671010 | 0.96 | NOS1 (0.33) | NOS1NOS2BACE1RAPGEF4 | |
| SCHEMBL25439645 | 0.95 | NOS1 (0.33) | NOS1NOS2BACE1 | |
| SCHEMBL20703459 | 0.95 | NOS1 (0.35) | NOS1NOS2BACE1 | |
| SCHEMBL4970674 | 0.93 | RAPGEF4 (0.34) | NOS1NOS2RAPGEF4 | |
| SCHEMBL4968598 | 0.92 | NOS1 (0.31) | NOS1NOS2 | |
| SCHEMBL812525 | 0.91 | NOS1 (0.39) | NOS1NOS2BACE1 | |
| SCHEMBL4969625 | 0.90 | MEN1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL811296 | 0.88 | NOS1 (0.37) | NOS1NOS2 |
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-2021126692-A1 | IRON BIS(IMINO) ARYL CATALYSTS AND METHODS THEREOF | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2021-06-24 | — | — | WO | disclosed |