Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.45 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27655322 | 0.95 | AOC3 (0.54) | AOC3ALDH1A1NPSR1RAB9APOLB | |
| SCHEMBL8421120 | 0.89 | AOC3 (0.57) | AOC3ALDH1A1NPSR1RAB9APOLB | |
| SCHEMBL13483465 | 0.86 | S1PR1 (0.56) | AOC3ALDH1A1NPSR1RAB9APOLB | |
| SCHEMBL22526066 | 0.85 | AOC3 (0.53) | AOC3ALDH1A1NPSR1RAB9APOLB | |
| SCHEMBL5074115 | 0.84 | RAB9A (0.57) | AOC3ALDH1A1NPSR1RAB9APOLB | |
| SCHEMBL8868314 | 0.84 | AOC3 (0.56) | AOC3ALDH1A1NPSR1RAB9APOLB | |
| SCHEMBL8419389 | 0.84 | AOC3 (0.56) | AOC3ALDH1A1NPSR1RAB9APOLB | |
| SCHEMBL7476616 | 0.84 | TP53 (0.49) | AOC3RAB9APOLBNPC1MEN1 | |
| SCHEMBL840217 | 0.84 | ALDH1A1 (0.59) | AOC3ALDH1A1NPSR1RAB9APOLB | |
| SCHEMBL5106598 | 0.84 | MEN1 (0.65) | AOC3ALDH1A1NPSR1RAB9APOLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007130499-A2 | ANTIVIRAL AGENTS | VIROBAY, INC. (US) | 2007-11-15 | — | — | WO | claimed |
| WO-2007130499-A2 | ANTIVIRAL AGENTS | VIROBAY, INC. (US) | 2007-11-15 | — | — | WO | disclosed |