Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1617171 | 0.98 | ALDH1A1 (0.51) | ALDH1A1GAACHRNA7CHRM2CHRM1 | |
| SCHEMBL5171234 | 0.98 | ALDH1A1 (0.51) | ALDH1A1GAACHRNA7CHRM2CHRM1 | |
| SCHEMBL2495325 | 0.98 | ALDH1A1 (0.51) | ALDH1A1GAACHRNA7CHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL15329139 | 0.95 | ALDH1A1 (0.54) | ALDH1A1GAACHRNA7CHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL5105833 | 0.95 | ALDH1A1 (0.54) | ALDH1A1GAACHRNA7CHRM2CHRM1 | |
| Acetic Acid SCHEMBL11614488 | 0.91 | ALDH1A1 (0.51) | ALDH1A1GAACHRNA7CHRM2CHRM1 | |
| SCHEMBL4339192 | 0.86 | CHRM2 (0.42) | ALDH1A1CHRNA7CHRM2CHRM1MEN1 | |
| SCHEMBL4762996 | 0.86 | CHRM2 (0.42) | ALDH1A1CHRNA7CHRM2CHRM1MEN1 | |
| SCHEMBL7493133 | 0.86 | CHRM2 (0.42) | ALDH1A1CHRNA7CHRM2CHRM1MEN1 | |
| Acetonitrile SCHEMBL28099504 | 0.86 | CHRM2 (0.49) | ALDH1A1GAACHRNA7CHRM2CHRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5324723-A | Analgesics | MERCK SHARPE & DOHME LTD. | 1994-06-28 | — | — | US | disclosed |
| EP-0307141-B1 | OXAZOLES AND THIAZOLES FOR THE TREATMENT OF SENILE DEMENTIA | MERCK SHARP & DOHME LTD. (GB) | 1993-01-13 | — | — | EP | disclosed |
| EP-0307141-A2 | Oxazoles and thiazoles for the treatment of senile dementia | MERCK SHARP & DOHME LTD. (GB) | 1989-03-15 | — | — | EP | disclosed |