Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 11/20 | 0.49 |
| ▸ | NOS1 | P29475 | 11/20 | 0.49 |
| ▸ | NOS2 | P35228 | 8/20 | 0.49 |
| ▸ | HTR6 | P50406 | 4/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12367568 | 0.86 | NOS3 (0.56) | NOS3NOS1NOS2HTR6CHRNB2 | |
| SCHEMBL27768895 | 0.85 | CHRNB2 (0.46) | NOS3NOS1NOS2HTR6CHRNB2 | |
| SCHEMBL27894537 | 0.83 | NTSR1 (0.46) | NOS3NOS1NOS2HTR6NTSR1 | |
| SCHEMBL2263565 | 0.82 | NOS3 (0.56) | NOS3NOS1NOS2HTR6 | |
| SCHEMBL1122077 | 0.77 | NOS3 (0.57) | NOS3NOS1NOS2HTR6CHRNB2 | |
| SCHEMBL2261758 | 0.76 | HTR6 (0.67) | NOS3NOS1NOS2HTR6CHRNB2 | |
| SCHEMBL2261753 | 0.76 | HTR6 (0.67) | NOS3NOS1NOS2HTR6CHRNB2 | |
| SCHEMBL2266154 | 0.73 | NOS3 (0.56) | NOS3NOS1NOS2HTR6 | |
| SCHEMBL8530808 | 0.72 | HTR6 (0.77) | NOS3NOS1NOS2HTR6 | |
| SCHEMBL2265023 | 0.72 | ADRA2A (0.46) | NOS3NOS1NOS2HTR6CHRNB2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101466709-B | 1,5 and 3, 6-substituted indole compounds having NOS inhibitory activity | NEURAXON INC | 2013-03-20 | — | — | CN | disclosed |
| CN-101466709-A | 1, 5 and 3, 6-substituted indole compounds having NOS inhibitory activity | NEURAXON INC (CA) | 2009-06-24 | — | — | CN | disclosed |