Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 5/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL7266907 | 0.81 | CHRM1 (0.49) | CHRM2CHRM1CHRM4CHRM3 | |
| SCHEMBL10369501 | 0.79 | CHRM1 (0.51) | CHRM2CHRM1CHRM4CHRM3 | |
| SCHEMBL7330432 | 0.77 | CHRM1 (0.42) | CHRM2CHRM1CHRM4CHRM3ALDH1A1 | |
| Oxalic Acid SCHEMBL10367531 | 0.77 | CHRM1 (0.45) | CHRM2CHRM1CHRM4CHRM3 | |
| SCHEMBL4762996 | 0.75 | CHRM2 (0.42) | CHRM2CHRM1CHRM4CHRM3ALDH1A1 | |
| SCHEMBL4339192 | 0.75 | CHRM2 (0.42) | CHRM2CHRM1CHRM4CHRM3ALDH1A1 | |
| SCHEMBL7493133 | 0.75 | CHRM2 (0.42) | CHRM2CHRM1CHRM4CHRM3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7499660 | 0.74 | ALDH1A1 (0.45) | CHRM2CHRM1CHRM4CHRM3ALDH1A1 | |
| Bromide SCHEMBL9298859 | 0.74 | CHRM2 (0.41) | CHRM2CHRM1CHRM4CHRM3ALDH1A1 | |
| SCHEMBL10368012 | 0.74 | CHRM2 (0.45) | CHRM2CHRM1CHRM4CHRM3ALDH1A1 |
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-0398617-A2 | Process for resolving 1-azabicyclo [2.2.1]heptane-3-carboxylates | MERCK SHARP & DOHME LTD. (GB) | 1990-11-22 | — | — | EP | disclosed |