Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13873125 | 0.86 | ALDH1A1 (0.66) | ALDH1A1MAPK1SMN1; SMN2NPSR1TSHR | |
| SCHEMBL14412882 | 0.85 | ALDH1A1 (0.70) | ALDH1A1MAPK1NPSR1TSHRTDP1 | |
| SCHEMBL13061271 | 0.84 | ALDH1A1 (0.60) | ALDH1A1MAPK1SMN1; SMN2NPSR1TSHR | |
| SCHEMBL13061265 | 0.84 | ALDH1A1 (0.62) | ALDH1A1MAPK1SMN1; SMN2NPSR1TSHR | |
| SCHEMBL4960188 | 0.82 | MAPT (0.72) | ALDH1A1MAPK1SMN1; SMN2NPSR1GLA | |
| SCHEMBL10250879 | 0.81 | ALDH1A1 (0.65) | ALDH1A1MAPK1SMN1; SMN2NPSR1TSHR | |
| SCHEMBL13006873 | 0.81 | ALDH1A1 (0.58) | ALDH1A1MAPK1SMN1; SMN2NPSR1TSHR | |
| SCHEMBL13003528 | 0.78 | MEN1 (0.61) | NPSR1TSHRKMT2A | |
| SCHEMBL13873384 | 0.78 | EPHX2 (0.68) | NPSR1MAPT | |
| SCHEMBL10352908 | 0.78 | MAPT (0.64) | ALDH1A1MAPK1SMN1; SMN2MAPT |
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-2007106705-A1 | SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHODS OF USING SAME | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-09-20 | — | — | WO | disclosed |