Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.40 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL3194118 | 0.83 | HPGD (0.47) | TSHRHPGDPOLBHTTMAOA | |
| SCHEMBL16795753 | 0.82 | MAOA (0.49) | TSHRMAOAMAOBMAPTALDH1A1 | |
| SCHEMBL16795842 | 0.82 | MAOA (0.48) | TSHRHTTMAOAMAOBMAPT | |
| SCHEMBL16795812 | 0.82 | HPGD (0.41) | HPGDMAOAMAOBMAPTALDH1A1 | |
| SCHEMBL16795519 | 0.82 | KCNQ3 (0.40) | HPGDPOLBHTTMAOAMAOB | |
| SCHEMBL17411406 | 0.81 | TSHR (0.47) | TSHRHPGDPOLBHTTMAOA | |
| SCHEMBL21294933 | 0.81 | TSHR (0.47) | TSHRHPGDPOLBHTTMAOA | |
| SCHEMBL2016516 | 0.81 | TSHR (0.47) | TSHRHPGDPOLBHTTMAOA | |
| SCHEMBL990763 | 0.81 | TSHR (0.47) | TSHRHPGDPOLBHTTMAOA | |
| SCHEMBL20619804 | 0.78 | MAOA (0.44) | TSHRHPGDPOLBHTTMAOA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015087094-A1 | NEW ARYLALKENYLPROPARGYLAMINE DERIVATIVES EXHIBITING NEUROPROTECTIVE ACTION FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | SEMMELWEIS EGYETEM (HU) | 2015-06-18 | — | — | WO | disclosed |