Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10089190 | 0.83 | CES1 (0.32) | ALDH1A1 | |
| SCHEMBL10269858 | 0.82 | — | — | |
| SCHEMBL14038082 | 0.82 | TSHR (0.33) | ACHETSHRTDP1ALDH1A1 | |
| SCHEMBL10193348 | 0.82 | CA1 (0.44) | ACHETSHRTDP1ALDH1A1 | |
| SCHEMBL14959227 | 0.82 | TSHR (0.33) | ACHETSHRTDP1ALDH1A1 | |
| SCHEMBL257866 | 0.77 | TRPA1 (0.31) | TSHRALDH1A1 | |
| SCHEMBL7877221 | 0.71 | KDM4E (0.38) | — | |
| SCHEMBL10305267 | 0.69 | ACHE (0.47) | ACHETSHRTDP1ALDH1A1 | |
| SCHEMBL21510034 | 0.69 | — | — | |
| P-Xylene SCHEMBL19859054 | 0.69 | ACHE (0.53) | ACHETSHRTDP1ALDH1A1 |
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-2012083164-A1 | ANTI-VIRAL COMPOUNDS | ABBOTT LABORATORIES (US) | 2012-06-21 | — | — | WO | disclosed |