Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL8446830 | 0.83 | NPC1 (0.48) | NPC1RAB9AMAPTKIF11TSHR | |
| SCHEMBL11136765 | 0.82 | POLB (0.49) | NPC1RAB9AMAPTALDH1A1LMNA | |
| SCHEMBL8351698 | 0.82 | ACACB (0.49) | NPC1RAB9AMAPTTSHRALDH1A1 | |
| SCHEMBL2432243 | 0.82 | MAPT (0.55) | MAPTGAAHDAC1HDAC6 | |
| SCHEMBL15308114 | 0.78 | NPC1 (0.44) | NPC1RAB9AMAPTTSHRALDH1A1 | |
| SCHEMBL7875157 | 0.78 | RAB9A (0.44) | NPC1RAB9AMAPTTSHRALDH1A1 | |
| SCHEMBL8445933 | 0.77 | HPGD (0.49) | NPC1RAB9AMAPTTSHRALDH1A1 | |
| SCHEMBL10921467 | 0.76 | SSTR4 (0.43) | NPC1RAB9AMAPTGAAHDAC1 | |
| SCHEMBL7904977 | 0.76 | RAB9A (0.52) | NPC1RAB9AMAPTALDH1A1LMNA | |
| SCHEMBL8351058 | 0.76 | NPC1 (0.46) | NPC1RAB9AMAPTKIF11TSHR |
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-2012080383-A2 | PERSONAL CARE COMPOSITIONS INCLUDING AQUEOUS COMPOSITIONS OF VISCOELASTIC SURFACTANTS AND HYDROPHOBICALLY MODIFIED POLYMERS | AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) | 2012-06-21 | — | — | WO | disclosed |