Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 10/20 | 0.46 |
| ▸ | NOS3 | P29474 | 9/20 | 0.46 |
| ▸ | NOS2 | P35228 | 4/20 | 0.46 |
| ▸ | HTR1D | P28221 | 2/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 4/20 | 0.41 |
| ▸ | CDK4 | P11802 | 2/20 | 0.40 |
| ▸ | CCND1 | P24385 | 2/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1121983 | 0.85 | NOS3 (0.60) | NOS1NOS3NOS2HTR1DHTR1B | |
| SCHEMBL1122127 | 0.83 | NOS1 (0.60) | NOS1NOS3NOS2 | |
| SCHEMBL1122207 | 0.81 | NOS1 (0.71) | NOS1NOS3NOS2 | |
| SCHEMBL1122330 | 0.80 | NOS3 (0.61) | NOS1NOS3NOS2HTR1DHTR1B | |
| SCHEMBL1122358 | 0.79 | NOS3 (0.60) | NOS1NOS3NOS2HTR1DHTR6 | |
| SCHEMBL12253663 | 0.78 | NOS3 (0.62) | NOS1NOS3NOS2HTR1DHTR6 | |
| Hydrochloric Acid SCHEMBL1122252 | 0.77 | NOS3 (0.62) | NOS1NOS3NOS2HTR6 | |
| SCHEMBL1122396 | 0.77 | NOS3 (0.62) | NOS1NOS3NOS2HTR1DHTR6 | |
| SCHEMBL15499701 | 0.74 | NOS1 (0.47) | NOS1NOS3NOS2 | |
| SCHEMBL13069732 | 0.73 | NOS1 (0.60) | NOS1NOS3NOS2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1883451-B9 | SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY | NEURAXON INC (CA) | 2011-02-09 | — | — | EP | claimed |
| EP-1883451-B1 | SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY | NEURAXON INC (CA) | 2010-11-24 | — | — | EP | claimed |