Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 13/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7848680 | 0.99 | ACHE (0.51) | ACHESIGMAR1BCHEHTR1AMEN1 | |
| SCHEMBL7847536 | 0.91 | ACHE (0.58) | ACHEBCHEHRH3 | |
| Hydrochloric Acid SCHEMBL7846888 | 0.90 | ACHE (0.57) | ACHEBCHE | |
| Hydrochloric Acid SCHEMBL7838353 | 0.85 | ALDH1A1 (0.52) | ACHESIGMAR1BCHEMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7847513 | 0.83 | ALDH1A1 (0.56) | ACHESIGMAR1BCHE | |
| Hydrochloric Acid SCHEMBL7850624 | 0.83 | ATM (0.53) | ACHESIGMAR1BCHE | |
| SCHEMBL7849351 | 0.80 | HRH3 (0.55) | ACHEBCHEHRH3CYP2D6HRH1 | |
| SCHEMBL7846350 | 0.80 | ACHE (0.53) | ACHESIGMAR1HTR1A | |
| SCHEMBL7846285 | 0.80 | HRH3 (0.54) | ACHEBCHEHRH3CYP2D6HRH1 | |
| SCHEMBL7848865 | 0.79 | CHRM4 (0.47) | ACHENPC1RAB9A |
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-1122252-A1 | NITROGENOUS FUSED HETEROCYCLE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME | Takeda Chemical Industries, Ltd. (JP) | 2001-08-08 | — | — | EP | disclosed |