Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL3585015 | 0.93 | MAPT (0.36) | MAPTCA12CA1CA2CA9 | |
| SCHEMBL3574966 | 0.86 | ITGA4 (0.35) | MAPTALDH1A1CYP3A4ALOX15TDP1 | |
| SCHEMBL3574028 | 0.81 | ALDH1A1 (0.40) | MAPTCA12CA1CA2CA9 | |
| SCHEMBL3586516 | 0.81 | ALDH1A1 (0.40) | MAPTCA1CA2ALDH1A1CYP3A4 | |
| SCHEMBL3572332 | 0.79 | CYP3A4 (0.33) | MAPTALDH1A1CYP3A4ALOX15TDP1 | |
| Trifluoroacetic Acid SCHEMBL3572326 | 0.76 | TYMS (0.39) | MAPTCA1CA2ALDH1A1CYP3A4 | |
| SCHEMBL3569098 | 0.72 | ALDH1A1 (0.39) | MAPTALDH1A1TDP1NPC1MAPK1 | |
| SCHEMBL616603 | 0.70 | GAA (0.63) | MAPTALDH1A1CYP3A4ALOX15TDP1 | |
| SCHEMBL28736276 | 0.69 | ALDH1A1 (0.44) | MAPTALDH1A1CYP3A4ALOX15TDP1 | |
| SCHEMBL19699034 | 0.68 | L3MBTL1 (0.53) | MAPTALDH1A1TDP1MAPK1L3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2150514-B1 | 18F-LABELLED FOLATES | Merck & Cie (CH) | 2018-10-24 | — | — | EP | disclosed |
| EP-2150514-A2 | 18F-LABELLED FOLATES | Merck Eprova AG (CH) | 2010-02-10 | — | — | EP | disclosed |
| WO-2008125617-A2 | 18F-LABELLED FOLATES | MERCK EPROVA AG (CH) | 2008-10-23 | — | — | WO | disclosed |