Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPI | P09923 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 6/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.36 |
| ▸ | DNMT1 | P26358 | 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 | |
|---|---|---|---|---|
| SCHEMBL2327183 | 1.00 | ALPI (0.39) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL2673161 | 0.87 | KIF11 (0.50) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL2673157 | 0.87 | KIF11 (0.50) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL11784699 | 0.81 | MAOA (0.55) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL17874881 | 0.81 | KIF11 (0.41) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL22922246 | 0.81 | MMP13 (0.39) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL17874627 | 0.80 | KIF11 (0.44) | MAOAMAOBKIF11MAPTMTNR1A | |
| SCHEMBL12910753 | 0.77 | MTNR1A (0.39) | ALPIPKMPTGS1XIAPSLC7A5 | |
| SCHEMBL18359871 | 0.76 | EHMT2 (0.47) | PKMMAPTHPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL4922553 | 0.73 | NOS2 (0.35) | PTGS1EPHX1 |
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-2019178166-A1 | AMPHIPHILIC THIOL COMPOUNDS AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2019-09-19 | — | — | WO | disclosed |