Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL655520 | 0.78 | CYP1A2 (0.43) | ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13068682 | 0.74 | GABRA1 (0.35) | ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13760578 | 0.72 | TRPA1 (0.30) | — | |
| SCHEMBL5613958 | 0.72 | GABRA1 (0.50) | ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL5712842 | 0.71 | MEN1 (0.40) | ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29738572 | 0.71 | MEN1 (0.40) | ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13068680 | 0.69 | IDO1 (0.36) | ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL14473089 | 0.69 | IDO1 (0.36) | ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL305225 | 0.69 | IDO1 (0.43) | ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4933638 | 0.69 | CYP1A2 (0.37) | ALDH1A1CYP1A2CYP2C9CYP2C19 |
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-2016044390-A1 | BORON-CONTAINING DIACYLHYDRAZINE COMPOUNDS | INTREXON CORPORATION (US) | 2016-03-24 | — | — | WO | disclosed |