Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL44903 | 0.90 | — | — | |
| SCHEMBL27932470 | 0.88 | — | — | |
| SCHEMBL28216165 | 0.72 | ALDH1A1 (0.33) | RAB9A | |
| Ethoxycarbonyl Group SCHEMBL27927717 | 0.72 | LMNA (0.33) | — | |
| SCHEMBL28292215 | 0.71 | MITF (0.37) | RAB9A | |
| SCHEMBL28216523 | 0.70 | MAPT (0.33) | RAB9A | |
| Ethyl Propionate SCHEMBL28290764 | 0.70 | MITF (0.48) | CYP3A4RAB9A | |
| SCHEMBL29708599 | 0.69 | — | — | |
| SCHEMBL31095437 | 0.63 | HTR2A (0.41) | RAB9A | |
| SCHEMBL6972639 | 0.61 | FBP1 (0.38) | — |
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-2014030142-A2 | NITROIMIDAZOLE COMPOUNDS AND THEIR USE IN CANCER THERAPY | AUCKLAND UNISERVICES LIMITED (NZ) | 2014-02-27 | — | — | WO | disclosed |