Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL4649436 | 0.86 | ALDH1A1 (0.59) | ALDH1A1CYP3A4TP53MAOBTSHR | |
| SCHEMBL21693972 | 0.85 | TDP1 (0.41) | ALDH1A1CYP3A4TSHRTDP1MAPT | |
| SCHEMBL21693963 | 0.83 | ALDH1A1 (0.52) | ALDH1A1CYP3A4TP53MAOBTSHR | |
| SCHEMBL7569627 | 0.83 | MAOB (0.60) | ALDH1A1CYP3A4TP53MAOBTSHR | |
| SCHEMBL21693995 | 0.81 | TDP1 (0.42) | ALDH1A1CYP3A4TSHRTDP1MAPT | |
| SCHEMBL21694034 | 0.81 | CYP3A4 (0.44) | ALDH1A1CYP3A4TP53MAOBTSHR | |
| SCHEMBL21694020 | 0.80 | CYP3A4 (0.37) | ALDH1A1CYP3A4TSHRTDP1MAPT | |
| SCHEMBL21694002 | 0.80 | CD44 (0.38) | ALDH1A1CYP3A4TP53TSHRTDP1 | |
| SCHEMBL21693954 | 0.79 | ALDH1A1 (0.41) | ALDH1A1CYP3A4TP53TSHRTDP1 | |
| SCHEMBL10582109 | 0.79 | CYP3A4 (0.61) | ALDH1A1CYP3A4TP53MAOBTSHR |
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-2020032091-A1 | EPOXY COMPOUND, EPOXY RESIN, EPOXY RESIN COMPOSITION, CURED RESIN PRODUCT, PREPREG, FIBER-REINFORCED COMPOSITE MATERIAL, AND PRODUCTION METHOD FOR THESE | 帝人株式会社 | 2020-02-13 | — | — | WO | disclosed |