Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 4/20 | 0.55 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.46 |
| ▸ | ABAT | P80404 | 1/20 | 0.46 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL574401 | 0.82 | ERN1 (0.53) | ERN1ALDH1A1CYP2A6CA1CA2 | |
| SCHEMBL25807310 | 0.81 | ERN1 (0.48) | ERN1ALDH1A1MAPTCA1CA2 | |
| SCHEMBL6955307 | 0.78 | ERN1 (0.46) | ERN1ALDH1A1MAPTHPGDMEN1 | |
| SCHEMBL8594827 | 0.78 | ERN1 (0.54) | ERN1ALDH1A1CYP2A6CA1CA2 | |
| SCHEMBL5913033 | 0.75 | ERN1 (0.51) | ERN1ALDH5A1ABATVCAM1ALDH1A1 | |
| SCHEMBL2571222 | 0.74 | ALDH1A1 (0.58) | ALDH5A1ABATVCAM1ALDH1A1MAPT | |
| SCHEMBL5180945 | 0.73 | ERN1 (0.48) | ERN1ALDH1A1CA1CA2CA9 | |
| SCHEMBL5937500 | 0.72 | APP (0.62) | ERN1ALDH1A1MAPTCYP2A6CA1 | |
| SCHEMBL13394253 | 0.71 | KDM4E (0.40) | ERN1ALDH1A1MAPTHPGDMEN1 | |
| SCHEMBL12767818 | 0.71 | ERN1 (1.00) | ERN1 |
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-110283179-B | Method for directly constructing indole-fused ring compound | 中国科学技术大学 | 2021-10-01 | — | — | CN | disclosed |