Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.49 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | CAMK2A | Q9UQM7 | 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 | |
|---|---|---|---|---|
| SCHEMBL27490536 | 0.88 | ALOX5 (0.51) | CYP3A4 | |
| SCHEMBL6061395 | 0.83 | HTR1A (0.53) | HRH1ABCB1HTR1ADRD2 | |
| SCHEMBL6936340 | 0.82 | HRH1 (0.50) | ARHRH1RIPK1SLC6A2SLC6A4 | |
| SCHEMBL29815703 | 0.81 | HRH1 (0.67) | ARHRH1RIPK1SLC6A2SLC6A4 | |
| SCHEMBL1696335 | 0.81 | HRH1 (0.67) | ARHRH1RIPK1SLC6A2SLC6A4 | |
| SCHEMBL11662258 | 0.81 | SLC6A4 (0.67) | ARHRH1RIPK1SLC6A2SLC6A4 | |
| SCHEMBL8431833 | 0.81 | MAOB (0.51) | ARHRH1RIPK1SLC6A2SLC6A4 | |
| SCHEMBL28738373 | 0.81 | AR (0.49) | ARHRH1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8693307 | 0.79 | CYP3A4 (0.48) | CYP3A4CAMK2A | |
| SCHEMBL2860919 | 0.78 | SLC6A2 (0.45) | ARHRH1SLC6A2SLC6A4SLC6A3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0888278-B1 | ANTIDIABETIC AGENTS | MERCK & CO INC (US) | 2003-07-23 | — | — | EP | disclosed |
| EP-0888278-A4 | ANTIDIABETIC AGENTS | MERCK & CO INC (US) | 1999-06-30 | — | — | EP | disclosed |
| EP-0888278-A1 | ANTIDIABETIC AGENTS | Merck & Co., Inc. (US) | 1999-01-07 | — | — | EP | disclosed |
| WO-1997028115-A1 | ANTIDIABETIC AGENTS | MERCK & CO., INC. (US) | 1997-08-07 | — | — | WO | disclosed |