Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | PREP | P48147 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14028941 | 0.84 | ALDH1A1 (0.50) | ALDH1A1TSHRGRM2PREPHTR2C | |
| SCHEMBL14028937 | 0.84 | ALDH1A1 (0.50) | ALDH1A1TSHRGRM2PREPHTR2C | |
| SCHEMBL14028930 | 0.84 | ALDH1A1 (0.50) | ALDH1A1TSHRGRM2PREPHTR2C | |
| SCHEMBL9189776 | 0.75 | ALDH1A1 (0.47) | ALDH1A1TSHRGRM2PREPKCNA5 | |
| SCHEMBL9194320 | 0.74 | ALDH1A1 (0.46) | ALDH1A1TSHRGRM2PREPHTR2C | |
| SCHEMBL13386604 | 0.72 | ALDH1A1 (0.55) | ALDH1A1TSHRKCNA5 | |
| SCHEMBL9187730 | 0.70 | ALDH1A1 (0.42) | ALDH1A1TSHRPREPMEN1KMT2A | |
| SCHEMBL9187721 | 0.70 | ALDH1A1 (0.42) | ALDH1A1TSHRPREPMEN1KMT2A | |
| SCHEMBL9187736 | 0.70 | ALDH1A1 (0.42) | ALDH1A1TSHRPREPMEN1KMT2A | |
| SCHEMBL27449506 | 0.70 | ALDH1A1 (0.45) | ALDH1A1TSHRPREPMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0362941-B1 | 4-Methyl and 4-ethyl substituted pyrrolidin-2-ones | MERCK SHARP & DOHME (GB) | 1995-12-20 | — | — | EP | disclosed |
| US-4925867-A | MUSCLE RELAXANTS, PREVENTION OF NEURODEGENERATIVE DISEASES | MERCK SHARP & DOHME LTD. (GB) | 1990-05-15 | — | — | US | disclosed |
| EP-0362941-A2 | 4-Methyl and 4-ethyl substituted pyrrolidin-2-ones | MERCK SHARP & DOHME LTD. (GB) | 1990-04-11 | — | — | EP | disclosed |