Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10071057 | 0.88 | CYP3A4 (0.43) | CYP3A4ALOX15GABRA1GABRB2ADRA2A | |
| SCHEMBL44672 | 0.87 | GABRA1 (0.48) | CYP3A4ALOX15GABRA1GABRB2ADRA2A | |
| SCHEMBL31130510 | 0.86 | CA1 (0.53) | CYP3A4ALOX15GABRA1GABRB2ADRA2A | |
| SCHEMBL7135448 | 0.86 | CA1 (0.53) | CYP3A4ALOX15GABRA1GABRB2ADRA2A | |
| SCHEMBL14999526 | 0.84 | CA1 (0.41) | GABRA1GABRB2ALDH1A1MEN1KMT2A | |
| SCHEMBL809675 | 0.82 | ALDH1A1 (0.36) | CYP3A4ALOX15ALDH1A1MEN1KMT2A | |
| SCHEMBL6056491 | 0.82 | ALDH1A1 (0.36) | CYP3A4ALOX15ALDH1A1MEN1KMT2A | |
| SCHEMBL16953029 | 0.82 | CA1 (0.40) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL16958729 | 0.81 | HMGCR (0.36) | ALDH1A1MEN1KMT2AGAA | |
| SCHEMBL16951902 | 0.80 | CA1 (0.45) | ALDH1A1SMN1; SMN2KDM4EMAPTMAPK1 |
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-3782977-A1 | CYCLOPROPANATION METHOD AND REAGENT | Fundació Privada Institut Català d'Investigació Química (ICIQ) (ES) | 2021-02-24 | — | — | EP | disclosed |