Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL78627 | 0.84 | TNF (0.34) | TNFRIPK1 | |
| SCHEMBL803641 | 0.83 | CYP3A4 (0.31) | CYP3A4ACHERAPGEF4 | |
| SCHEMBL20457052 | 0.81 | CYP3A4 (0.31) | CYP3A4 | |
| SCHEMBL12286582 | 0.80 | NOTUM (0.38) | TNFRIPK1 | |
| SCHEMBL10824240 | 0.77 | CYP3A4 (0.33) | CYP3A4 | |
| SCHEMBL24981754 | 0.77 | ACHE (0.33) | RIPK1ACHE | |
| SCHEMBL24945815 | 0.77 | DAO (0.35) | TNFRIPK1CYP3A4 | |
| SCHEMBL15780875 | 0.74 | HTR2A (0.37) | CYP3A4RAPGEF4 | |
| SCHEMBL13905953 | 0.74 | ACHE (0.38) | TNFRIPK1CYP3A4ACHERAPGEF4 | |
| SCHEMBL2578269 | 0.74 | ACHE (0.38) | TNFRIPK1CYP3A4ACHERAPGEF4 |
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 |
|---|---|---|---|---|---|---|---|
| US-8129538-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-06 | — | — | US | disclosed |