Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CD38 | P28907 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3152054 | 0.98 | NPC1 (0.42) | NPC1CD38LMNAEPHX2 | |
| SCHEMBL15362702 | 0.91 | NPC1 (0.50) | NPC1LMNAEPHX2ACHESMN1; SMN2 | |
| SCHEMBL2976961 | 0.91 | NPC1 (0.50) | NPC1LMNAEPHX2ACHESMN1; SMN2 | |
| SCHEMBL5236196 | 0.91 | NPC1 (0.50) | NPC1LMNAEPHX2ACHESMN1; SMN2 | |
| SCHEMBL11228022 | 0.91 | NPC1 (0.50) | NPC1LMNAEPHX2ACHESMN1; SMN2 | |
| SCHEMBL14359727 | 0.89 | NPC1 (0.46) | NPC1LMNAEPHX2ACHESMN1; SMN2 | |
| SCHEMBL28236249 | 0.85 | NPC1 (0.45) | NPC1LMNAEPHX2ACHESMN1; SMN2 | |
| SCHEMBL22414144 | 0.85 | NPC1 (0.45) | NPC1LMNAEPHX2ACHESMN1; SMN2 | |
| SCHEMBL18330523 | 0.84 | — | — | |
| SCHEMBL11350663 | 0.83 | NPC1 (0.42) | NPC1EPHX2 |
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-1867650-B1 | HYDROXYMETHYLBORON COMPOUNDS | EISAI R&D MAN CO LTD (JP) | 2012-06-27 | — | — | EP | claimed |