Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 8/20 | 0.45 |
| ▸ | HSD11B2 | P80365 | 3/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21077918 | 0.98 | ALDH1A1 (0.48) | ALDH1A1TSHRKEAP1HSD11B1HSD11B2 | |
| SCHEMBL21078144 | 0.95 | KEAP1 (0.44) | ALDH1A1TSHRKEAP1HSD11B1HSD11B2 | |
| SCHEMBL21078112 | 0.92 | HPGD (0.42) | ALDH1A1TSHRKEAP1NAMPTHPGD | |
| SCHEMBL21077917 | 0.84 | NAMPT (0.48) | ALDH1A1NAMPTHPGD | |
| SCHEMBL21078110 | 0.81 | JAK1 (0.37) | ALDH1A1TSHRKEAP1NAMPTHPGD | |
| SCHEMBL17888277 | 0.81 | KEAP1 (0.54) | ALDH1A1TSHRKEAP1HSD11B1HSD11B2 | |
| SCHEMBL21078128 | 0.79 | NAMPT (0.50) | NAMPT | |
| SCHEMBL17888264 | 0.79 | KEAP1 (0.51) | ALDH1A1TSHRKEAP1HSD11B1HSD11B2 | |
| SCHEMBL21077851 | 0.78 | JAK1 (0.35) | ALDH1A1TSHRNAMPT | |
| SCHEMBL17886616 | 0.78 | TSHR (0.49) | ALDH1A1TSHRKEAP1HSD11B1HSD11B2 |
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-3041841-B1 | TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | HOFFMANN LA ROCHE (CH) | 2019-06-05 | — | — | EP | disclosed |