Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 2/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 2/20 | 0.33 |
| ▸ | PPARA | Q07869 | 2/20 | 0.33 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.33 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.33 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Cyclohexylamine SCHEMBL11565837 | 0.83 | TP53 (0.50) | MMP8MMP1MMP2ALDH1A1SMN1; SMN2 | |
| Cyclohexylamine SCHEMBL28154438 | 0.83 | MMP8 (0.46) | MMP8MMP1MMP2SLC7A5EPHX1 | |
| Valine SCHEMBL8706964 | 0.82 | SLC7A5 (0.60) | MMP8MMP1MMP2ALDH1A1SMN1; SMN2 | |
| Valine SCHEMBL28257081 | 0.82 | SLC7A5 (0.60) | MMP8MMP1MMP2ALDH1A1SMN1; SMN2 | |
| Cyclohexane SCHEMBL28875717 | 0.79 | TP53 (0.40) | ALDH1A1SMN1; SMN2SLC7A5SLC1A3SLC1A2 | |
| Cyclohexylamine SCHEMBL27738388 | 0.77 | MMP8 (0.43) | MMP8MMP1MMP2ALDH1A1SMN1; SMN2 | |
| Cyclohexylamine SCHEMBL27242018 | 0.77 | MMP8 (0.43) | MMP8MMP1MMP2ALDH1A1SMN1; SMN2 | |
| Cyclohexylamine SCHEMBL1427270 | 0.77 | MMP8 (0.43) | MMP8MMP1MMP2ALDH1A1SMN1; SMN2 | |
| Cyclohexylamine SCHEMBL974340 | 0.77 | CES2 (0.43) | MMP8MMP1MMP2ALDH1A1SMN1; SMN2 | |
| Cyclooctanamine SCHEMBL11193013 | 0.77 | CES2 (0.43) | MMP8MMP1MMP2ALDH1A1SMN1; SMN2 |
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-1996011927-A1 | ENDOTHELIN ANTAGONISTS | ABBOTT LABORATORIES (US) | 1996-04-25 | — | — | WO | disclosed |