Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | PDE6D | O43924 | 2/20 | 0.46 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.46 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
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 SCHEMBL15569268 | 0.92 | MAPT (0.52) | MAPTALDH1A1PDE6DALDH2ALDH3A1 | |
| Trifluoroacetic Acid SCHEMBL15569065 | 0.88 | MAPT (0.56) | MAPTDRD2TBXA2RALDH1A1PDE6D | |
| Trifluoroacetic Acid SCHEMBL15568649 | 0.82 | ALDH1A1 (0.57) | MAPTDRD2TBXA2RALDH1A1PDE6D | |
| Trifluoroacetic Acid SCHEMBL15568526 | 0.79 | MAPT (0.58) | MAPTALDH1A1PDE6DALDH2ALDH3A1 | |
| SCHEMBL15569562 | 0.79 | ALDH1A1 (0.52) | MAPTDRD2TBXA2RALDH1A1PDE6D | |
| Trifluoroacetic Acid SCHEMBL15568270 | 0.78 | MAPT (0.57) | MAPTDRD2TBXA2RALDH1A1PDE6D | |
| Trifluoroacetic Acid SCHEMBL15567957 | 0.78 | LMNA (0.51) | MAPTDRD2TBXA2RALDH1A1PDE6D | |
| Trifluoroacetic Acid SCHEMBL15568322 | 0.77 | ALDH1A1 (0.65) | MAPTDRD2TBXA2RALDH1A1PDE6D | |
| Trifluoroacetic Acid SCHEMBL15568324 | 0.77 | DRD2 (0.50) | MAPTDRD2TBXA2RALDH1A1PDE6D | |
| SCHEMBL29056606 | 0.76 | ALDH1A1 (0.65) | MAPTDRD2TBXA2RALDH1A1PDE6D |
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-2014027053-A1 | BENZIMIDAZOLES FOR THE TREATMENT OF CANCER | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2014-02-20 | — | — | WO | disclosed |