Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL31090802 | 0.93 | CYP1A2 (0.62) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL3789145 | 0.93 | CYP1A2 (0.62) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL25135228 | 0.92 | MAOB (0.58) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL30393884 | 0.91 | CYP1A2 (0.61) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL30393807 | 0.91 | CYP1A2 (0.65) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL3785409 | 0.86 | CYP1A2 (0.56) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL3784764 | 0.86 | CYP3A4 (0.59) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL25135225 | 0.84 | NCOA1 (0.57) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL5906230 | 0.84 | GAA (0.64) | CYP1A2CYP2C9CYP2C19CYP3A4GAA | |
| SCHEMBL29003782 | 0.82 | NCOA1 (0.47) | CYP1A2CYP2C9CYP2C19CYP3A4GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5480965-A | BASED ON A NOVEL DIAMINO COMPOUND DERIVED FROM BENZOPHENONE STRUCTURE; FIBER REINFORCEMENT | MITSUI TOATSU CHEMICALS, INC. (JP) | 1996-01-02 | — | — | US | disclosed |