Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CPB1 | P15086 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL145262 | 0.86 | TSHR (0.60) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL472070 | 0.85 | SMN1; SMN2 (0.48) | TSHRALDH1A1GAACA1CA2 | |
| SCHEMBL717144 | 0.85 | SMN1; SMN2 (0.48) | TSHRALDH1A1GAACA1CA2 | |
| SCHEMBL3306289 | 0.85 | SMN1; SMN2 (0.48) | TSHRALDH1A1GAACA1CA2 | |
| SCHEMBL29129479 | 0.84 | TSHR (0.54) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL28595580 | 0.84 | TSHR (0.54) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL5674337 | 0.83 | ALDH1A1 (0.54) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL29385701 | 0.81 | TSHR (0.51) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL9741141 | 0.80 | CA12 (0.54) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL28595583 | 0.80 | TSHR (0.53) | TSHRALDH1A1GAACA12CA1 |
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-2017133657-A1 | PYRIDINE AND PYRIMIDINE DERIVATIVES AND THEIR USE IN TREATMENT, AMELIORATION OR PREVENTION OF INFLUENZA | SAVIRA PHARMACEUTICALS GMBH (AT) | 2017-08-10 | — | — | WO | disclosed |