Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BRD2 | P25440 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.35 |
| ▸ | FABP7 | O15540 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29858668 | 0.86 | ATAD2 (0.47) | LMNACA12CA1CA2CA7 | |
| SCHEMBL2810136 | 0.73 | NPC1 (0.68) | NPC1LMNACYP1A2CYP3A4MAOA | |
| SCHEMBL1278720 | 0.73 | NPC1 (0.68) | NPC1LMNACYP1A2CYP3A4MAOA | |
| Hydrochloric Acid SCHEMBL9156219 | 0.72 | NPC1 (0.66) | NPC1LMNACYP1A2CYP3A4MAOA | |
| SCHEMBL31398152 | 0.71 | MAPK14 (0.41) | CYP3A4PIK3CAPIK3CDFABP7SMN1; SMN2 | |
| SCHEMBL20657452 | 0.71 | KDM4E (0.38) | NPC1CYP1A2PIK3CAPIK3CDRAB9A | |
| SCHEMBL4155667 | 0.70 | NPC1 (0.47) | NPC1LMNACYP1A2CYP3A4MAOA | |
| SCHEMBL30730411 | 0.69 | LIPE (0.46) | NPC1LMNAPIK3CAPIK3CDBRD4 | |
| SCHEMBL30730345 | 0.69 | PIK3CA (0.40) | PIK3CAPIK3CDBRD4FABP7ELANE | |
| SCHEMBL584117 | 0.69 | NPC1 (0.62) | NPC1LMNACYP1A2CYP3A4MAOA |
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-2023060173-A1 | COMPOUNDS, COMPOSITIONS AND METHODS OF USE | AQUINNAH PHARMACEUTICALS, INC. (US) | 2023-04-13 | — | — | WO | disclosed |