Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL372682 | 0.98 | AKR1C1 (0.42) | AKR1C1NPSR1NPC1RAB9ACA12 | |
| SCHEMBL17113633 | 0.98 | AKR1C1 (0.42) | AKR1C1NPSR1NPC1RAB9ACA12 | |
| SCHEMBL15688938 | 0.96 | NPC1 (0.41) | AKR1C1NPSR1NPC1RAB9ACA12 | |
| SCHEMBL14830900 | 0.93 | NPC1 (0.43) | NPSR1NPC1RAB9ACA12CA9 | |
| SCHEMBL5177324 | 0.81 | OPRM1 (0.43) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL185865 | 0.81 | NPC1 (0.40) | NPSR1NPC1RAB9ACA12CA9 | |
| SCHEMBL17500050 | 0.79 | NPC1 (0.39) | NPSR1NPC1RAB9ACA12CA9 | |
| SCHEMBL14830423 | 0.79 | NPC1 (0.49) | NPSR1NPC1RAB9ACA12CA9 | |
| SCHEMBL29164055 | 0.78 | SMN1; SMN2 (0.52) | NPC1RAB9AMEN1KMT2ALMNA | |
| SCHEMBL16096494 | 0.77 | NPC1 (0.43) | NPSR1NPC1RAB9ACA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2509424-A1 | NOVEL OXADIAZOLE COMPOUNDS | Abbott Laboratories (US) | 2012-10-17 | — | — | EP | disclosed |
| WO-2011071570-A1 | NOVEL OXADIAZOLE COMPOUNDS | ABBOTT LABORATORIES (US) | 2011-06-16 | — | — | WO | disclosed |