Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ARG1 | P05089 | 1/20 | 0.35 |
| ▸ | ARG2 | P78540 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13519612 | 0.92 | ARG1 (0.38) | ARG1ARG2NOS3NOS1NOS2 | |
| SCHEMBL14131190 | 0.89 | ROCK2 (0.37) | HRH3ROCK2ROCK1 | |
| SCHEMBL9974271 | 0.82 | ARG1 (0.35) | ARG1ARG2HRH3ROCK2ROCK1 | |
| SCHEMBL16625962 | 0.82 | ARG1 (0.35) | ARG1ARG2HRH3ROCK2ROCK1 | |
| SCHEMBL16625965 | 0.82 | ARG1 (0.35) | ARG1ARG2HRH3ROCK2ROCK1 | |
| SCHEMBL16625961 | 0.80 | GBA1 (0.42) | HRH3OPRL1 | |
| SCHEMBL441047 | 0.79 | — | — | |
| SCHEMBL172560 | 0.79 | CARM1 (0.44) | HRH3 | |
| SCHEMBL14131035 | 0.78 | GBA1 (0.38) | HRH3 | |
| SCHEMBL16627426 | 0.78 | DRD2 (0.43) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015050472-A1 | FUSED INDOLE COMPOUNDS AND METHODS OF USING SAME | OBSCHESTVO S OGRANICHENNOY OTVETSTVENNOST'YU "PANACELA LABS" (RU) | 2015-04-09 | — | — | WO | disclosed |
| WO-2015050471-A1 | CARBAZOLE COMPOUNDS AND METHODS OF USING SAME | OBSCHESTVO S OGRANICHENNOY OTVETSTVENNOST'YU "PANACELA LABS" (RU) | 2015-04-09 | — | — | WO | disclosed |