Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 13/20 | 0.42 |
| ▸ | NOS1 | P29475 | 13/20 | 0.42 |
| ▸ | NOS2 | P35228 | 8/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14404488 | 0.83 | NOS3 (0.47) | NOS3NOS1NOS2CYP3A4CYP2C19 | |
| SCHEMBL2263676 | 0.83 | NOS3 (0.64) | NOS3NOS1NOS2CYP3A4CYP2C19 | |
| SCHEMBL2260904 | 0.82 | NOS3 (0.60) | NOS3NOS1NOS2CYP3A4CYP2C19 | |
| SCHEMBL12367336 | 0.82 | NOS3 (0.60) | NOS3NOS1NOS2CYP3A4CYP2C19 | |
| SCHEMBL2262963 | 0.82 | NOS3 (0.49) | NOS3NOS1NOS2CYP3A4CYP2C19 | |
| SCHEMBL2264612 | 0.80 | NOS3 (0.62) | NOS3NOS1NOS2CYP3A4CYP2C19 | |
| SCHEMBL12367651 | 0.80 | NOS3 (0.62) | NOS3NOS1NOS2CYP3A4CYP2C19 | |
| SCHEMBL2264641 | 0.80 | NOS3 (0.49) | NOS3NOS1NOS2CYP3A4CYP2C19 | |
| SCHEMBL12367706 | 0.79 | NOS3 (0.54) | NOS3NOS1NOS2CYP3A4CYP2C19 | |
| SCHEMBL2260911 | 0.78 | NOS3 (0.46) | NOS3NOS1NOS2CYP3A4CYP2C19 |
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-2010527-B1 | 1,5 AND 3,6- SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY | NEURAXON INC (CA) | 2013-08-14 | — | — | EP | disclosed |
| WO-2007118314-A1 | 1,5 AND 3,6- SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY | NEURAXON, INC. (CA) | 2007-10-25 | — | — | WO | disclosed |