Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | HTR6 | P50406 | 3/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.45 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10872396 | 0.86 | MPO (0.44) | GAAHTR6RAB9AALDH1A1 | |
| SCHEMBL7697312 | 0.82 | GAA (0.53) | GAAGRIN2BGRIN1EGFRERBB2 | |
| SCHEMBL9307952 | 0.81 | NPC1 (0.46) | GAAHTR6GRIN2BGRIN1NPC1 | |
| SCHEMBL7564203 | 0.81 | HTR6 (0.44) | GAAHTR6GRIN2BGRIN1EGFR | |
| SCHEMBL21072507 | 0.80 | KMT2A (0.54) | PKMKMT2A | |
| SCHEMBL6582523 | 0.80 | DDAH1 (0.42) | HTR6ALDH1A1 | |
| SCHEMBL7504985 | 0.79 | TP53 (0.44) | NPC1RAB9ACYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8817554 | 0.79 | PRNP (0.56) | GAAHTR6GRIN2BGRIN1NPC1 | |
| SCHEMBL9306184 | 0.78 | GAA (0.42) | GAAHTR6GRIN2BGRIN1CYP1A2 | |
| SCHEMBL5071826 | 0.78 | PNP (0.52) | GAACYP3A4ALDH1A1MEN1KMT2A |
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-0252507-A1 | 2-(4-Pyridylaminomethyl)-benzimidazole derivatives having antiviral activity | Maruishi Seiyaku Kabushiki Kaisha (JP) | 1988-01-13 | — | — | EP | disclosed |