Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.59 |
| ▸ | RAB9A | P51151 | 4/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.51 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SRD5A1 | P18405 | 3/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.41 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.40 |
| ▸ | S100A4 | P26447 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL15106295 | 0.82 | RAB9A (0.77) | NPC1RAB9AMAPTHSD17B1SRD5A1 | |
| SCHEMBL15897526 | 0.82 | SRD5A2 (0.63) | NPC1RAB9AMAPTHSD17B1BAZ2B | |
| SCHEMBL10193085 | 0.80 | BAZ2B (0.65) | NPC1RAB9AMAPTHSD17B1BAZ2B | |
| SCHEMBL33121 | 0.77 | ALDH1A1 (0.68) | NPC1RAB9AMAPTHSD17B1ALDH1A1 | |
| SCHEMBL30692090 | 0.75 | RAB9A (1.00) | NPC1RAB9AMAPTHSD17B1SRD5A2 | |
| SCHEMBL3399487 | 0.75 | RAB9A (1.00) | NPC1RAB9AMAPTHSD17B1SRD5A2 | |
| SCHEMBL29809406 | 0.75 | SRD5A2 (0.72) | NPC1RAB9AMAPTHSD17B1SRD5A1 | |
| SCHEMBL8941746 | 0.75 | SRD5A2 (0.72) | NPC1RAB9AMAPTHSD17B1SRD5A1 | |
| SCHEMBL1466022 | 0.73 | NPC1 (0.67) | NPC1RAB9AMAPTHSD17B1ALDH1A1 | |
| SCHEMBL31048932 | 0.73 | NPC1 (0.67) | NPC1RAB9AMAPTHSD17B1ALDH1A1 |
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-2013021344-A1 | IMIDAZOLE DERIVATIVES AS ANTIVIRAL AGENTS | LUPIN LIMITED (IN) | 2013-02-14 | — | — | WO | disclosed |