Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL3822200 | 1.00 | SIGMAR1 (0.37) | SIGMAR1NOS3NOS1NOS2DRD2 | |
| SCHEMBL203650 | 0.87 | SIGMAR1 (0.43) | SIGMAR1NOS3NOS1NOS2 | |
| SCHEMBL11750040 | 0.87 | SIGMAR1 (0.43) | SIGMAR1NOS3NOS1NOS2 | |
| SCHEMBL25365 | 0.87 | — | — | |
| SCHEMBL1101260 | 0.84 | DRD2 (0.33) | SIGMAR1DRD2 | |
| Water SCHEMBL29754132 | 0.84 | — | — | |
| SCHEMBL18454688 | 0.84 | DRD2 (0.33) | SIGMAR1DRD2 | |
| Hydrochloric Acid SCHEMBL3675933 | 0.84 | SIGMAR1 (0.42) | SIGMAR1NOS3NOS1NOS2 | |
| Hydrochloric Acid SCHEMBL1641825 | 0.84 | — | — | |
| SCHEMBL18768190 | 0.83 | — | — |
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-2021262426-A9 | ADAMANTANE AMIDES AND THIOAMIDES FOR THE TREATMENT OF EBOLAVIRUS INFECTION | ARISAN THERAPEUTICS INC. (US) | 2022-03-17 | — | — | WO | disclosed |