Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.57 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.48 |
| ▸ | PCSK9 | Q8NBP7 | 2/20 | 0.47 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 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 | |
|---|---|---|---|---|
| SCHEMBL18509418 | 0.82 | SOS2 (0.71) | HTR2ASCN9ASLC6A4SOS2PCSK9 | |
| SCHEMBL5151098 | 0.82 | SOS2 (0.71) | HTR2ASCN9ASLC6A4SOS2PCSK9 | |
| SCHEMBL5151105 | 0.82 | SOS2 (0.71) | HTR2ASCN9ASLC6A4SOS2PCSK9 | |
| SCHEMBL30916157 | 0.82 | SOS2 (0.70) | HTR2ASLC6A4SOS2PCSK9RIPK1 | |
| SCHEMBL18509675 | 0.80 | SCN9A (0.80) | HTR2ASCN9ASLC6A4SOS2TNF | |
| SCHEMBL838121 | 0.80 | TNF (0.64) | HTR2ASLC6A4SOS2RIPK1AHR | |
| SCHEMBL837413 | 0.80 | TNF (0.64) | HTR2ASLC6A4SOS2RIPK1AHR | |
| SCHEMBL30495964 | 0.80 | TNF (0.64) | HTR2ASLC6A4SOS2RIPK1AHR | |
| SCHEMBL18028962 | 0.80 | TNF (0.64) | HTR2ASLC6A4SOS2RIPK1AHR | |
| SCHEMBL3467251 | 0.80 | TNF (0.64) | HTR2ASLC6A4SOS2RIPK1AHR |
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-3081214-A2 | INHIBITORS OF CELLULAR NECROSIS | THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) | 2016-10-19 | — | — | EP | disclosed |