Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 12/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10476092 | 0.85 | EPHX1 (0.44) | EPHX1ACHEALDH1A1RAB9ANPC1 | |
| SCHEMBL7368744 | 0.85 | EPHX1 (0.44) | EPHX1ACHEALDH1A1RAB9ANPC1 | |
| SCHEMBL11100479 | 0.78 | EPHX1 (0.52) | EPHX1ACHEALDH1A1RAB9ANPC1 | |
| SCHEMBL27960635 | 0.77 | ALDH1A1 (0.45) | EPHX1ACHEALDH1A1RAB9ANPC1 | |
| Ammonia Solution, Strong SCHEMBL27626603 | 0.77 | EPHX1 (0.50) | EPHX1ACHEALDH1A1RAB9ANPC1 | |
| SCHEMBL7773645 | 0.76 | ALDH1A1 (0.48) | EPHX1ACHEALDH1A1RAB9ANPC1 | |
| SCHEMBL9264188 | 0.76 | EPHX1 (0.46) | EPHX1ACHEALDH1A1RAB9ANPC1 | |
| SCHEMBL9286243 | 0.74 | ALDH1A1 (0.50) | EPHX1ACHEALDH1A1RAB9ANPC1 | |
| SCHEMBL14746245 | 0.74 | EPHX1 (0.41) | EPHX1ACHEALDH1A1RAB9ANPC1 | |
| SCHEMBL6318148 | 0.74 | EPHX1 (0.47) | EPHX1ACHEALDH1A1ATM |
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-2011033009-A1 | N- [2-HYDROXYCARBAMOYL-2- (PIPERAZINYL) ETHYL] BENZAMIDE COMPOUNDS, THEIR PREPARATION AND THEIR USE AS TACE INHIBITORS | GALDERMA RESEARCH & DEVELOPMENT (FR) | 2011-03-24 | — | — | WO | disclosed |