Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.53 |
| ▸ | CCR5 | P51681 | 1/20 | 0.52 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL7985996 | 0.87 | GAA (0.56) | GAACHRM3SMPD1NPC1ALDH1A1 | |
| SCHEMBL17142140 | 0.86 | HDAC2 (0.64) | GAACHRM3EPHX2HDAC2HDAC8 | |
| SCHEMBL7986109 | 0.86 | MAOB (0.55) | GAACHRM3SMPD1NPC1ALDH1A1 | |
| SCHEMBL7972494 | 0.86 | MAOB (0.55) | GAACHRM3SMPD1NPC1ALDH1A1 | |
| SCHEMBL7233161 | 0.85 | CHRM3 (0.54) | GAACHRM3SMPD1EPHX2HDAC2 | |
| SCHEMBL5091359 | 0.85 | CHRM3 (0.54) | GAACHRM3EPHX2HDAC2HDAC8 | |
| SCHEMBL7983783 | 0.85 | MAOB (0.54) | GAACHRM3SMPD1NPC1ALDH1A1 | |
| SCHEMBL7983889 | 0.85 | MAOB (0.54) | GAACHRM3SMPD1NPC1ALDH1A1 | |
| SCHEMBL7982716 | 0.85 | MAOB (0.54) | GAACHRM3SMPD1NPC1ALDH1A1 | |
| SCHEMBL28146231 | 0.84 | CHRM3 (0.55) | GAACHRM3EPHX2HDAC2HDAC8 |
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-6221914-B1 | ANTIINFLAMMATORY AGENTS | ARRAY BIOPHARMA INC. | 2001-04-24 | — | — | US | disclosed |