Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL20181606 | 0.81 | PMP22 (0.33) | KDM4ECYP2D6CYP2C19BLMNPSR1 | |
| SCHEMBL28246970 | 0.78 | ECE1 (0.32) | BLMTP53CA1CA2CA9 | |
| SCHEMBL17337272 | 0.73 | GABRP (0.41) | — | |
| SCHEMBL10425679 | 0.71 | — | — | |
| SCHEMBL31511632 | 0.69 | — | — | |
| SCHEMBL18246035 | 0.69 | — | — | |
| SCHEMBL27159371 | 0.69 | — | — | |
| SCHEMBL28144836 | 0.68 | TSHR (0.39) | KDM4ECA1CA2CA9 | |
| SCHEMBL295045 | 0.68 | — | — | |
| SCHEMBL19641926 | 0.68 | CA1 (0.38) | TP53CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018093580-A1 | TRIAZOLE PYRIDYL COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR | AMGEN INC. (US) | 2018-05-24 | — | — | WO | disclosed |