Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | S100A4 | P26447 | 2/20 | 0.44 |
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | STAT6 | P42226 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6823018 | 0.90 | PTPN1 (0.49) | PTPN1ALDH1A1TDP1MAPTKMT2A | |
| SCHEMBL6822719 | 0.89 | PTPN1 (0.48) | PTPN1ALDH1A1TDP1MAPTKMT2A | |
| SCHEMBL30535903 | 0.73 | ALDH1A1 (0.74) | PTPN1ALDH1A1TDP1KMT2ARECQL | |
| SCHEMBL1287837 | 0.73 | ALDH1A1 (0.74) | PTPN1ALDH1A1TDP1KMT2ARECQL | |
| SCHEMBL8993582 | 0.72 | ALDH1A1 (0.61) | PTPN1ALDH1A1TDP1MAPTKMT2A | |
| SCHEMBL17449581 | 0.72 | ALDH1A1 (0.48) | PTPN1ALDH1A1TDP1MAPTKMT2A | |
| SCHEMBL12365077 | 0.71 | SRD5A2 (0.45) | ALDH1A1TDP1MAPTKMT2ALMNA | |
| SCHEMBL29337140 | 0.71 | ALDH1A1 (0.71) | PTPN1ALDH1A1TDP1KMT2AS100A4 | |
| SCHEMBL30987815 | 0.71 | ALDH1A1 (0.71) | PTPN1ALDH1A1TDP1KMT2AS100A4 | |
| Ammonia Solution, Strong SCHEMBL9060371 | 0.71 | ALDH1A1 (0.71) | PTPN1ALDH1A1TDP1KMT2AS100A4 |
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-2004096766-A1 | A METHOD OF INDOLE SYNTHESIS | THE AUSTRALIAN NATIONAL UNIVERSITY (AU) | 2004-11-11 | — | — | WO | disclosed |