Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 1/20 | 0.61 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.57 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | PLAU | P00749 | 2/20 | 0.42 |
| ▸ | PLAT | P00750 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.42 |
| ▸ | F3 | P13726 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | F2 | P00734 | 4/20 | 0.41 |
| ▸ | F10 | P00742 | 4/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31373106 | 0.97 | AKR1C3 (0.62) | MAPTSMN1; SMN2NPC1HPGDRAB9A | |
| SCHEMBL18309808 | 0.83 | MAPT (0.54) | MAPTSMN1; SMN2NPC1HPGDRAB9A | |
| SCHEMBL9298000 | 0.83 | CYP1A2 (0.73) | MAPTSMN1; SMN2NPC1HPGDRAB9A | |
| SCHEMBL9200839 | 0.83 | CYP1A2 (0.73) | MAPTSMN1; SMN2NPC1HPGDRAB9A | |
| SCHEMBL28807076 | 0.83 | EGFR (0.57) | MAPTSMN1; SMN2NPC1HPGDRAB9A | |
| SCHEMBL29169520 | 0.81 | CYP1A2 (0.71) | MAPTSMN1; SMN2NPC1HPGDRAB9A | |
| SCHEMBL3438121 | 0.80 | CYP1A2 (0.70) | MAPTSMN1; SMN2NPC1HPGDRAB9A | |
| SCHEMBL13777344 | 0.80 | CYP1A2 (0.70) | MAPTSMN1; SMN2NPC1HPGDRAB9A | |
| SCHEMBL3438123 | 0.80 | CYP1A2 (0.70) | MAPTSMN1; SMN2NPC1HPGDRAB9A | |
| SCHEMBL1524722 | 0.79 | EGFR (0.53) | MAPTSMN1; SMN2NPC1HPGDRAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109111334-B | Chiral 2-arylmethylene cycloalkanol and asymmetric synthesis method thereof | 三峡大学 | 2020-07-28 | — | — | CN | disclosed |
| CN-109111334-A | A kind of chirality 2- aryl methylene cyclic alkanol and its method of asymmetric synthesis | 三峡大学 | 2019-01-01 | — | — | CN | disclosed |