Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.43 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | STAT6 | P42226 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.36 |
| ▸ | PRKDC | P78527 | 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 | |
|---|---|---|---|---|
| SCHEMBL269610 | 0.86 | HPGD (0.47) | HPGDNR1H4MYCHCRTR1HCRTR2 | |
| SCHEMBL8823046 | 0.82 | SMN1; SMN2 (0.51) | HPGDALDH1A1MAPTSMN1; SMN2KDM4E | |
| SCHEMBL3006440 | 0.81 | NPC1 (0.41) | HPGDHCRTR1HCRTR2ALDH1A1MAPT | |
| SCHEMBL1340822 | 0.81 | MAPK14 (0.50) | HPGDNR1H4MYCIKBKBALDH1A1 | |
| SCHEMBL4068223 | 0.78 | KDM4E (0.51) | HPGDALDH1A1MAPTSMN1; SMN2KDM4E | |
| SCHEMBL27814745 | 0.77 | MCL1 (0.43) | HCRTR1HCRTR2ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL1340229 | 0.76 | PIN1 (0.52) | IKBKBMEN1KMT2APIN1 | |
| SCHEMBL2547639 | 0.74 | KDM4E (0.47) | HPGDALDH1A1MAPTSMN1; SMN2KDM4E | |
| SCHEMBL1340615 | 0.74 | HCRTR1 (0.41) | HPGDMYCHCRTR1HCRTR2SMN1; SMN2 | |
| SCHEMBL269670 | 0.74 | KMT2A (0.46) | HPGDHCRTR1HCRTR2ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2334643-A1 | PHENETHYLAMIDE DERIVATIVES AND THEIR HETEROCYCLIC ANALOGUES | Actelion Pharmaceuticals Ltd. (CH) | 2011-06-22 | — | — | EP | disclosed |
| WO-2010044054-A1 | PHENETHYLAMIDE DERIVATIVES AND THEIR HETEROCYCLIC ANALOGUES | ACTELION PHARMACEUTICALS LTD (CH) | 2010-04-22 | — | — | WO | disclosed |