Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SAT1 | P21673 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3004896 | 0.79 | CYP2C19 (0.33) | SAT1 | |
| SCHEMBL31162552 | 0.74 | HTR1D (0.30) | — | |
| SCHEMBL4459636 | 0.69 | — | — | |
| SCHEMBL19586814 | 0.67 | SAT1 (0.35) | SAT1MAOAMAOB | |
| SCHEMBL11798220 | 0.67 | SAT1 (0.57) | SAT1MAOAMAOB | |
| SCHEMBL15839797 | 0.66 | — | — | |
| SCHEMBL16359016 | 0.66 | — | — | |
| SCHEMBL16302372 | 0.64 | — | — | |
| SCHEMBL14393104 | 0.64 | ALDH1A1 (0.32) | — | |
| SCHEMBL20046980 | 0.61 | MEN1 (0.46) | SAT1MAOAMAOB |
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-2459560-B1 | RING-ANNULATED DIHYDROPYRROLO[2,L-A]ISOQUINOLINES | MERCK SHARP & DOHME (NL) | 2015-08-19 | — | — | EP | disclosed |