Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 4/20 | 0.36 |
| ▸ | THRB | P10828 | 4/20 | 0.36 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.30 |
| ▸ | TBK1 | Q9UHD2 | 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 | |
|---|---|---|---|---|
| SCHEMBL19763316 | 0.82 | — | — | |
| SCHEMBL16599568 | 0.82 | THRA (0.37) | THRATHRBSMN1; SMN2 | |
| SCHEMBL16615619 | 0.80 | THRA (0.36) | THRATHRBSLC6A5ALDH1A1SMN1; SMN2 | |
| SCHEMBL16615508 | 0.80 | THRA (0.37) | THRATHRBSLC6A5ALDH1A1SMN1; SMN2 | |
| SCHEMBL18012155 | 0.78 | THRA (0.38) | THRATHRBSLC6A5ALDH1A1SMN1; SMN2 | |
| SCHEMBL16615602 | 0.74 | THRA (0.33) | THRATHRBSLC6A5 | |
| SCHEMBL16615603 | 0.74 | THRA (0.33) | THRATHRB | |
| SCHEMBL16615627 | 0.72 | — | — | |
| SCHEMBL18271369 | 0.72 | — | — | |
| SCHEMBL16615507 | 0.68 | THRA (0.32) | THRATHRBALDH1A1SMN1; SMN2 |
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-2015048363-A1 | SUBSTITUTED QUINOLIZINE DERIVATIVES USEFUL AS HIV INTEGRASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2015-04-02 | — | — | WO | disclosed |