Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6534548 | 0.78 | MAPT (0.43) | CYP3A4ALDH1A1LMNAMAPTMAOB | |
| SCHEMBL4864045 | 0.71 | NFE2L2 (0.72) | ABCG2ALDH1A1LMNAMAPTNR1H4 | |
| SCHEMBL5313681 | 0.70 | NR1H4 (0.64) | MAPTNR1H4ARMAOBNFE2L2 | |
| SCHEMBL7199009 | 0.70 | ABCG2 (0.51) | CYP3A4ABCG2MAPTNR1H4AR | |
| SCHEMBL7188988 | 0.69 | CYP3A4 (0.42) | CYP3A4ABCG2ALDH1A1LMNAMAPT | |
| SCHEMBL8146116 | 0.69 | ABCG2 (0.69) | CYP3A4ABCG2LMNANR1H4AR | |
| SCHEMBL6635025 | 0.66 | NPC1 (0.50) | CYP3A4ABCG2ALDH1A1MAPTNFE2L2 | |
| SCHEMBL7802805 | 0.66 | CYP3A4 (0.49) | CYP3A4ABCG2ALDH1A1LMNAMAPT | |
| SCHEMBL7190596 | 0.65 | ALOX5 (0.55) | CYP3A4ABCG2ALDH1A1LMNAMAPT | |
| SCHEMBL7188164 | 0.65 | PDE4A (0.70) | CYP3A4ABCG2ALDH1A1LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-115770270-A | Daoluotong and its use method | 朱亚琼 | 2023-03-10 | — | — | CN | disclosed |