Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP3 | O14638 | 1/20 | 0.39 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | CCR1 | P32246 | 1/20 | 0.38 |
| ▸ | CCR5 | P51681 | 1/20 | 0.38 |
| ▸ | CCR8 | P51685 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 6/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | KMO | O15229 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | KDM4A | O75164 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13426428 | 0.81 | POLB (0.39) | ENPP3ALPLXIAPPTGS2NOS1 | |
| SCHEMBL3434581 | 0.79 | GRM5 (0.44) | ENPP3ALPLXIAPGRM5MAPT | |
| SCHEMBL3433897 | 0.79 | KDM4C (0.34) | JMJD6GRM5KDM4CMAPTKDM5B | |
| SCHEMBL3395627 | 0.77 | ALPL (0.47) | ENPP3ALPLXIAPALDH1A1NPC1 | |
| SCHEMBL3398387 | 0.77 | PTGS2 (0.53) | MAPTPTGS2KMOPKMNPC1 | |
| SCHEMBL3433500 | 0.72 | PDE4B (0.48) | ALPLALDH1A1NPC1KDM4E | |
| SCHEMBL827247 | 0.71 | CCR1 (0.48) | GRM5CCR1CCR5CCR8MAPT | |
| SCHEMBL3399530 | 0.68 | PTGS2 (0.49) | MAPTALDH1A1L3MBTL1PTGS2NPC1 | |
| SCHEMBL13425460 | 0.67 | FAAH (0.36) | MAPTALDH1A1L3MBTL1NOS1NOS2 | |
| SCHEMBL23119743 | 0.66 | JMJD6 (0.57) | JMJD6CCR1CCR5CCR8KDM5B |
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-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |