Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.41 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 3/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7985989 | 0.87 | FFAR1 (0.39) | KDM4ENPC1ALDH1A1RAB9ALTA4H | |
| SCHEMBL7989431 | 0.80 | MMP9 (0.51) | KDM4ENPC1ALDH1A1RAB9ALTA4H | |
| SCHEMBL7989427 | 0.80 | MMP9 (0.51) | KDM4ENPC1ALDH1A1RAB9ALTA4H | |
| SCHEMBL7975789 | 0.79 | MAOB (0.47) | KDM4ENPC1ALDH1A1RAB9ALTA4H | |
| SCHEMBL7975785 | 0.79 | MAOB (0.47) | KDM4ENPC1ALDH1A1RAB9ALTA4H | |
| SCHEMBL7986420 | 0.79 | NPC1 (0.40) | KDM4ENPC1ALDH1A1 | |
| SCHEMBL7993925 | 0.73 | CYP2C19 (0.39) | KDM4E | |
| SCHEMBL7977831 | 0.72 | MMP2 (0.44) | — | |
| SCHEMBL7977828 | 0.72 | MMP2 (0.44) | — | |
| SCHEMBL19359053 | 0.71 | BCHE (0.53) | LTA4HALOX5 |
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-2001040198-A2 | MACROCYCLIC HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS ANTIMICROBIAL AGENTS | AVENTIS PHARMA S.A. (FR) | 2001-06-07 | — | — | WO | disclosed |