Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | BHMT | Q93088 | 1/20 | 0.36 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.34 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2785652 | 0.90 | MCL1 (0.40) | ALDH1A1LMNAATMMAPTTDP1 | |
| SCHEMBL11112780 | 0.84 | SLC22A6 (0.47) | ALDH1A1SMN1; SMN2LMNABHMTSLC22A6 | |
| SCHEMBL258152 | 0.82 | SLC22A6 (0.50) | ALDH1A1SMN1; SMN2BHMTSLC22A6MAPT | |
| SCHEMBL14895499 | 0.79 | ECE1 (0.35) | ALDH1A1LMNAATMMAPTMCL1 | |
| Ethane SCHEMBL5968227 | 0.79 | SLC22A6 (0.47) | ALDH1A1SMN1; SMN2LMNABHMTSLC22A6 | |
| SCHEMBL14109598 | 0.79 | SLC22A6 (0.47) | ALDH1A1SMN1; SMN2LMNABHMTSLC22A6 | |
| SCHEMBL11112412 | 0.79 | SLC22A6 (0.47) | ALDH1A1SMN1; SMN2LMNABHMTSLC22A6 | |
| SCHEMBL10902055 | 0.79 | SLC22A6 (0.47) | ALDH1A1SMN1; SMN2LMNABHMTSLC22A6 | |
| Ammonia Solution, Strong SCHEMBL28582304 | 0.79 | TDP1 (0.53) | ALDH1A1SMN1; SMN2LMNABHMTSLC22A6 | |
| SCHEMBL6738239 | 0.79 | SLC22A6 (0.47) | ALDH1A1SMN1; SMN2LMNABHMTSLC22A6 |
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-2008117305-A2 | A NOVEL PROCESS FOR PREPARING PREGABALIN AND ITS ACID ADDITION SALTS | GLENMARK PHARMACEUTICALS LIMITED (IN) | 2008-10-02 | — | — | WO | disclosed |