Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 4/20 | 0.46 |
| ▸ | NOS2 | P35228 | 4/20 | 0.46 |
| ▸ | NOS3 | P29474 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2162280 | 1.00 | NOS1 (0.46) | NOS1NOS2NOS3MEN1KMT2A | |
| SCHEMBL2877803 | 1.00 | NOS1 (0.46) | NOS1NOS2NOS3MEN1KMT2A | |
| SCHEMBL2878425 | 1.00 | NOS1 (0.46) | NOS1NOS2NOS3MEN1KMT2A | |
| SCHEMBL12976065 | 0.98 | NOS1 (0.44) | NOS1NOS2NOS3MEN1KMT2A | |
| SCHEMBL2162157 | 0.95 | — | — | |
| SCHEMBL28755839 | 0.82 | NOS1 (0.39) | NOS1NOS2NOS3MEN1KMT2A | |
| SCHEMBL5831802 | 0.82 | NOS1 (0.39) | NOS1NOS2NOS3MEN1KMT2A | |
| SCHEMBL2164863 | 0.78 | NOS1 (0.38) | NOS1NOS2NOS3MEN1KMT2A | |
| SCHEMBL8444427 | 0.76 | THRB (0.41) | MEN1KMT2ATHRB | |
| Hydrochloric Acid SCHEMBL7420511 | 0.74 | THRB (0.39) | NOS1NOS2NOS3MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3110810-B1 | PYRAZOLE AMIDE DERIVATIVE | TEIJIN PHARMA LTD (JP) | 2018-05-02 | — | — | EP | disclosed |