Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.53 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | XBP1 | P17861 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL9854682 | 0.82 | MTNR1A (0.53) | MTNR1AMTNR1BSIGMAR1CYP2D6SLC6A2 | |
| SCHEMBL696008 | 0.82 | ALDH1A1 (0.60) | ALDH1A1MTNR1AMTNR1BXBP1HTT | |
| SCHEMBL7279700 | 0.82 | ALDH1A1 (0.60) | ALDH1A1MTNR1AMTNR1BXBP1HTT | |
| SCHEMBL696007 | 0.82 | ALDH1A1 (0.60) | ALDH1A1MTNR1AMTNR1BXBP1HTT | |
| SCHEMBL697601 | 0.82 | ALDH1A1 (0.60) | ALDH1A1MTNR1AMTNR1BXBP1HTT | |
| SCHEMBL697600 | 0.82 | ALDH1A1 (0.60) | ALDH1A1MTNR1AMTNR1BXBP1HTT | |
| SCHEMBL4866618 | 0.77 | ALDH1A1 (0.83) | ALDH1A1MTNR1AMTNR1BHTTEPHX2 | |
| SCHEMBL30985347 | 0.77 | ALDH1A1 (0.83) | ALDH1A1MTNR1AMTNR1BHTTEPHX2 | |
| SCHEMBL4858887 | 0.77 | ALDH1A1 (0.83) | ALDH1A1MTNR1AMTNR1BHTTEPHX2 | |
| SCHEMBL14698658 | 0.77 | ALDH1A1 (0.83) | ALDH1A1MTNR1AMTNR1BHTTEPHX2 |
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-0420064-A2 | Substituted 2-amidotetralins as melatonin agonists and antagonists | NORTHWESTERN UNIVERSITY (US) | 1991-04-03 | — | — | EP | disclosed |