Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.56 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.52 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6555821 | 0.82 | MTNR1B (0.64) | ALDH1A1TP53HSD17B10MTNR1AMTNR1B | |
| SCHEMBL3351763 | 0.80 | KMT2A (0.60) | ALDH1A1 | |
| SCHEMBL4075703 | 0.79 | SMN1; SMN2 (0.55) | ALDH1A1LMNATP53 | |
| SCHEMBL8928212 | 0.79 | MTNR1A (0.70) | ALDH1A1LMNAMTNR1AMTNR1B | |
| SCHEMBL2628663 | 0.79 | TRPM8 (0.49) | ALDH1A1LMNAPLA2G1BATG4BTP53 | |
| SCHEMBL1970142 | 0.77 | HTR2A (0.54) | ALDH1A1HSD17B10 | |
| SCHEMBL7838949 | 0.77 | KMT2A (0.74) | ALDH1A1 | |
| SCHEMBL27678438 | 0.76 | MTNR1A (0.50) | ALDH1A1CYP1A2CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL10310338 | 0.76 | KMT2A (0.47) | ALDH1A1HSD17B10 | |
| SCHEMBL8549452 | 0.75 | KMT2A (0.61) | ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010044054-A1 | PHENETHYLAMIDE DERIVATIVES AND THEIR HETEROCYCLIC ANALOGUES | ACTELION PHARMACEUTICALS LTD (CH) | 2010-04-22 | — | — | WO | claimed |
| WO-2010044054-A1 | PHENETHYLAMIDE DERIVATIVES AND THEIR HETEROCYCLIC ANALOGUES | ACTELION PHARMACEUTICALS LTD (CH) | 2010-04-22 | — | — | WO | disclosed |