Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 10/20 | 0.41 |
| ▸ | RAB9A | P51151 | 10/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.40 |
| ▸ | PRNP | P04156 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 6/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL15445194 | 0.90 | NPC1 (0.54) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL15445193 | 0.87 | NPC1 (0.41) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL20953445 | 0.73 | NPC1 (0.40) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL20953446 | 0.71 | NPC1 (0.37) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL15445209 | 0.69 | NPC1 (0.53) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL15445189 | 0.66 | NPC1 (0.37) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5569588 | 0.65 | NPC1 (0.46) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL16941641 | 0.63 | TSHR (0.46) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL15436025 | 0.63 | TSHR (0.46) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL15445206 | 0.63 | TSHR (0.46) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 |
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-2690105-A1 | Mannose derivatives, a process for preparing the same and their uses as a drug | Centre National De La Recherche Scientifique (FR) | 2014-01-29 | — | — | EP | disclosed |