Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | GFPT1 | Q06210 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | VNN1 | O95497 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5745387 | 0.96 | RAB9A (0.50) | RAB9ANPC1SMN1; SMN2MAPK1GFPT1 | |
| SCHEMBL5744453 | 0.86 | GFPT1 (0.44) | RAB9ANPC1SMN1; SMN2GFPT1KMT2A | |
| Trifluoroacetic Acid SCHEMBL5767994 | 0.86 | GFPT1 (0.51) | MAPK1GFPT1L3MBTL1VNN1NR1H2 | |
| SCHEMBL5745432 | 0.81 | LMNA (0.48) | SMN1; SMN2MAPK1GFPT1KMT2AMEN1 | |
| Trifluoroacetic Acid SCHEMBL5767572 | 0.81 | ALDH1A1 (0.50) | SMN1; SMN2MAPK1GFPT1KMT2AMEN1 | |
| SCHEMBL5744619 | 0.81 | GFPT1 (0.49) | SMN1; SMN2MAPK1GFPT1KMT2AMEN1 | |
| Trifluoroacetic Acid SCHEMBL5809778 | 0.80 | GFPT1 (0.46) | RAB9ANPC1SMN1; SMN2MAPK1GFPT1 | |
| Trifluoroacetic Acid SCHEMBL5768592 | 0.80 | GFPT1 (0.63) | GFPT1KMT2AMEN1L3MBTL1 | |
| Trifluoroacetic Acid SCHEMBL5763821 | 0.79 | GAA (0.51) | SMN1; SMN2MAPK1GFPT1KMT2AMEN1 | |
| SCHEMBL5744347 | 0.79 | VNN1 (0.49) | RAB9ANPC1SMN1; SMN2GFPT1VNN1 |
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-1631551-A2 | ISOQUINOLINE DERIVATIVES AND THEIR USE AS GFAT INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-03-08 | — | — | EP | disclosed |
| WO-2004101528-A2 | ISOQUINOLINE DERIVATIVES AND THEIR USE AS GFAT INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-11-25 | — | — | WO | disclosed |