Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ACLY | P53396 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL9632138 | 1.00 | ALDH1A1 (0.41) | ALDH1A1TSHRTP53L3MBTL1ACLY | |
| Trifluoroacetic Acid SCHEMBL1525100 | 1.00 | ALDH1A1 (0.41) | ALDH1A1TSHRTP53L3MBTL1ACLY | |
| Trifluoroacetic Acid SCHEMBL4163974 | 1.00 | ALDH1A1 (0.41) | ALDH1A1TSHRTP53L3MBTL1ACLY | |
| Trifluoroacetic Acid SCHEMBL4809831 | 1.00 | ALDH1A1 (0.41) | ALDH1A1TSHRTP53L3MBTL1ACLY | |
| Trifluoroacetic Acid SCHEMBL19552090 | 1.00 | ALDH1A1 (0.41) | ALDH1A1TSHRTP53L3MBTL1ACLY | |
| Trifluoroacetic Acid SCHEMBL60574 | 1.00 | ALDH1A1 (0.41) | ALDH1A1TSHRTP53L3MBTL1ACLY | |
| Trifluoroacetic Acid SCHEMBL19552101 | 1.00 | ALDH1A1 (0.41) | ALDH1A1TSHRTP53L3MBTL1ACLY | |
| Trifluoroacetic Acid SCHEMBL996801 | 0.97 | ALDH1A1 (0.39) | ALDH1A1TSHRTP53L3MBTL1ACLY | |
| Trifluoroacetic Acid SCHEMBL11086962 | 0.97 | ALDH1A1 (0.39) | ALDH1A1TSHRTP53L3MBTL1ACLY | |
| Trifluoroacetic Acid SCHEMBL4872786 | 0.94 | TSHR (0.37) | ALDH1A1TSHRTP53L3MBTL1ACLY |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2155676-A2 | COMPOUNDS WITH ANTIPARASITIC ACTIVITY, APPLICATIONS THEREOF TO THE TREATMENT OF INFECTIOUS DISEASES CAUSED BY APICOMPLEXANS | Commissariat à l'Energie Atomique (FR) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008146172-A2 | COMPOUNDS WITH ANTIPARASITIC ACTIVITY, APPLICATIONS THEREOF TO THE TREATMENT OF INFECTIOUS DISEASES CAUSED BY APICOMPLEXANS | COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) | 2008-12-04 | — | — | WO | disclosed |