Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORB | Q92753 | 5/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 3/20 | 0.34 |
| ▸ | VNN1 | O95497 | 2/20 | 0.34 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4705528 | 0.94 | RORB (0.43) | RORBGRM2RPS6KB1IDH1RORC | |
| SCHEMBL4708480 | 0.92 | RORB (0.42) | RORBGRM2RPS6KB1IDH1RORC | |
| SCHEMBL4705879 | 0.87 | RORB (0.42) | RORBGRM2IDH1RORC | |
| SCHEMBL4705482 | 0.87 | RORB (0.41) | RORBGRM2IDH1RORCVNN1 | |
| SCHEMBL4708468 | 0.86 | RORB (0.41) | RORBGRM2IDH1NTRK1RORC | |
| SCHEMBL4708122 | 0.86 | RORB (0.39) | RORBGRM2IDH1NTRK1RORC | |
| SCHEMBL4705301 | 0.85 | RORB (0.42) | RORBGRM2RPS6KB1RORCKCNN4 | |
| SCHEMBL4708283 | 0.84 | RORB (0.39) | RORBGRM2IDH1RORCSCN5A | |
| SCHEMBL4704941 | 0.84 | RORB (0.40) | RORBNTRK1RORCKCNN4P2RX7 | |
| SCHEMBL27538912 | 0.81 | RORB (0.44) | RORBIDH1RORCVNN1SCN5A |
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-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |