Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.50 |
| ▸ | FEN1 | P39748 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.42 |
| ▸ | CHRNG | P07510 | 1/20 | 0.42 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.42 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5954219 | 0.84 | THRA (0.53) | ALDH1A1HPGDERCC5FEN1PARP1 | |
| Hydrochloric Acid SCHEMBL5858790 | 0.83 | THRA (0.52) | ALDH1A1HPGDERCC5FEN1PARP1 | |
| SCHEMBL634434 | 0.82 | ERCC5 (0.57) | ALDH1A1HPGDERCC5FEN1PARP1 | |
| SCHEMBL5954123 | 0.81 | CTNNB1 (0.49) | HPGDPARP1KCNH2MAPTHTT | |
| SCHEMBL5953952 | 0.80 | GSK3B (0.53) | ALDH1A1ERCC5FEN1MAPTKMT2A | |
| SCHEMBL6322827 | 0.80 | KMT2A (0.67) | ALDH1A1HPGDMAPTGAAHTT | |
| SCHEMBL633895 | 0.79 | ALDH1A1 (0.57) | ALDH1A1HPGDERCC5FEN1PARP1 | |
| Hydrochloric Acid SCHEMBL10670271 | 0.78 | KMT2A (0.65) | ALDH1A1HPGDMAPTGAAKMT2A | |
| SCHEMBL4394372 | 0.78 | ERCC5 (0.57) | ALDH1A1ERCC5FEN1PARP1KMT2A | |
| SCHEMBL116338 | 0.78 | ERCC5 (0.61) | ALDH1A1HPGDERCC5FEN1PARP1 |
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 |