Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | BCHE | P06276 | 1/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.55 |
| ▸ | ACHE | P22303 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL3205671 | 0.87 | TAAR1 (0.72) | TAAR1NPSR1ALDH1A1HSD17B10MEN1 | |
| SCHEMBL5843237 | 0.81 | MAPK8 (0.50) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL22170167 | 0.80 | TAAR1 (0.67) | TAAR1NPSR1ALDH1A1HSD17B10MEN1 | |
| SCHEMBL1010680 | 0.80 | LMNA (0.64) | TAAR1MEN1KMT2APOLBMAPT | |
| SCHEMBL3993600 | 0.79 | NPSR1 (0.79) | TAAR1NPSR1BCHECHRM2ACHE | |
| SCHEMBL2826584 | 0.79 | GAA (0.64) | TAAR1ALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL29907950 | 0.79 | GAA (0.64) | TAAR1ALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL1520822 | 0.79 | NPSR1 (0.68) | NPSR1ALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL28465013 | 0.78 | NPC1 (0.81) | TAAR1NPSR1ALDH1A1MEN1KMT2A | |
| SCHEMBL9447512 | 0.78 | CA12 (0.65) | TAAR1NPSR1BCHECHRM2ACHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-1452522-A2 | Novel compounds and compositions as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2004-09-01 | — | — | EP | disclosed |