Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | AR | P10275 | 7/20 | 0.48 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | PARP1 | P09874 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.36 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.36 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13362121 | 0.94 | ALDH1A1 (0.61) | ALDH1A1MAPTARSIRT6CA12 | |
| SCHEMBL30806668 | 0.79 | KIF11 (0.46) | ARSIRT6CA12CA9LMNA | |
| SCHEMBL12824550 | 0.79 | ALDH1A1 (0.61) | ALDH1A1MAPTARHTTTSHR | |
| SCHEMBL20214487 | 0.78 | PNMT (0.50) | ALDH1A1MAPTSIRT6CA12CA9 | |
| SCHEMBL2206444 | 0.76 | ALDH1A1 (0.67) | ALDH1A1MAPTARLMNAHTT | |
| SCHEMBL8646022 | 0.76 | ALDH1A1 (0.62) | ALDH1A1MAPTCA12CA9CYP3A4 | |
| SCHEMBL31451405 | 0.75 | AR (0.51) | ALDH1A1MAPTARSIRT6CA12 | |
| SCHEMBL19410987 | 0.74 | AR (0.51) | ALDH1A1MAPTARPARP1PARP10 | |
| SCHEMBL2267850 | 0.73 | MAPT (0.67) | ALDH1A1MAPTSIRT6LMNACYP3A4 | |
| SCHEMBL394896 | 0.73 | MAPT (1.00) | ALDH1A1MAPTCA12CA9CYP3A4 |
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-2922845-B1 | ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF | MERIAL INC (US) | 2018-06-20 | — | — | EP | disclosed |