Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLCN2 | P51788 | 1/20 | 0.44 |
| ▸ | ACLY | P53396 | 1/20 | 0.44 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.41 |
| ▸ | PLK1 | P53350 | 6/20 | 0.40 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.39 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22365614 | 0.90 | MEN1 (0.47) | CSNK2A1PLK1AKR1C3AKR1C2PLK3 | |
| SCHEMBL21118622 | 0.84 | NPC1 (0.43) | CLCN2GRIK1MEN1KMT2AGAA | |
| SCHEMBL23616119 | 0.83 | AKR1C3 (0.55) | AKR1C3AKR1C2MEN1KMT2AGAA | |
| SCHEMBL23018133 | 0.81 | HPGD (0.38) | CSNK2A1AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL19902996 | 0.80 | KMT2A (0.52) | AKR1C3AKR1C2MEN1KMT2AGAA | |
| SCHEMBL14850897 | 0.77 | RAPGEF4 (0.43) | MEN1KMT2AGAAALDH1A1HSD17B10 | |
| SCHEMBL16067425 | 0.76 | RAPGEF4 (0.43) | MEN1KMT2AGAAALDH1A1HPGD | |
| SCHEMBL21118611 | 0.75 | KDM4E (0.51) | ACLYAKR1C3AKR1C2ALDH1A1HSD17B10 | |
| SCHEMBL23616122 | 0.74 | MEN1 (0.51) | AKR1C3AKR1C2MEN1KMT2AGFER | |
| SCHEMBL22877003 | 0.74 | ALDH1A1 (0.32) | MEN1KMT2AGAAALDH1A1HPGD |
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-3619199-B1 | PREPARATION OF 2-([1,2,3]TRIAZOL-2-YL)-BENZOIC ACID DERIVATIVES | IDORSIA PHARMACEUTICALS LTD (CH) | 2021-07-07 | — | — | EP | disclosed |