Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC5 | P28715 | 1/20 | 0.53 |
| ▸ | FEN1 | P39748 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | THRA | P10827 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9743797 | 0.92 | ERCC5 (0.60) | ERCC5FEN1ALDH1A1MAPTHPGD | |
| SCHEMBL634434 | 0.84 | ERCC5 (0.57) | ERCC5FEN1ALDH1A1MAPTHPGD | |
| SCHEMBL27946951 | 0.83 | THRA (0.50) | ALDH1A1MAPTTHRATHRBPARP1 | |
| SCHEMBL6266591 | 0.82 | ERCC5 (0.50) | ERCC5FEN1ALDH1A1MAPTHPGD | |
| SCHEMBL633895 | 0.81 | ALDH1A1 (0.57) | ERCC5FEN1ALDH1A1MAPTHPGD | |
| SCHEMBL3210555 | 0.80 | THRA (0.60) | ALDH1A1MAPTTHRATHRBHPGD | |
| SCHEMBL634225 | 0.80 | ALDH1A1 (0.56) | ERCC5FEN1ALDH1A1MAPTHPGD | |
| Hydrochloric Acid SCHEMBL28760001 | 0.79 | THRA (0.59) | ALDH1A1MAPTTHRATHRBHPGD | |
| SCHEMBL3728405 | 0.79 | ERCC5 (0.53) | ERCC5FEN1ALDH1A1MAPTHPGD | |
| SCHEMBL634326 | 0.78 | ALDH1A1 (0.55) | ERCC5FEN1ALDH1A1MAPTHPGD |
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-2419400-A1 | MONOAMINE REUPTAKE INHIBITORS | RESEARCH TRIANGLE INSTITUTE (US) | 2012-02-22 | — | — | EP | disclosed |