Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.31 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.30 |
| ▸ | PGR | P06401 | 2/20 | 0.30 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.30 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10343769 | 0.73 | AOC3 (0.39) | AOC3 | |
| SCHEMBL10584516 | 0.72 | AOC3 (0.39) | ACHEAOC3LMNA | |
| SCHEMBL28049563 | 0.69 | ACP3 (0.42) | MEN1KMT2AMAPTLMNAKCNH2 | |
| SCHEMBL28049484 | 0.67 | TRPA1 (0.44) | AOC3LMNATRPA1 | |
| SCHEMBL28805788 | 0.67 | OPRM1 (0.39) | NFE2L2ACHEMEN1KMT2AAOC3 | |
| SCHEMBL3690665 | 0.64 | ACHE (0.46) | NFE2L2ACHEMEN1KMT2AMAPT | |
| SCHEMBL10343697 | 0.64 | CYP1A2 (0.34) | ACHEMAPTLMNA | |
| SCHEMBL28049578 | 0.64 | PTPN1 (0.37) | MEN1KMT2ALMNATRPA1CYP2D6 | |
| SCHEMBL28049460 | 0.64 | TAAR1 (0.40) | NFE2L2MEN1KMT2ACYP2D6 | |
| SCHEMBL27854163 | 0.61 | AOC3 (0.35) | ACHEMEN1KMT2AAOC3TRPA1 |
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-1982001874-A1 | 2-(1,4-BENZODOIOXAN-2-YLALKYL)IMIDAZOLES USEFUL AS ANTIDEPRESSANTS | SYNTEX INC (US) | 1982-06-10 | — | — | WO | disclosed |