Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.48 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | STS | P08842 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4618978 | 1.00 | PARP1 (0.51) | PARP1NPC1RAB9ACES2CES1 | |
| SCHEMBL4622849 | 1.00 | PARP1 (0.51) | PARP1NPC1RAB9ACES2CES1 | |
| SCHEMBL4621579 | 0.83 | GPR139 (0.50) | PARP1NPC1RAB9ACES2CES1 | |
| SCHEMBL4621602 | 0.83 | GPR139 (0.50) | PARP1NPC1RAB9ACES2CES1 | |
| SCHEMBL4620281 | 0.83 | GPR139 (0.50) | PARP1NPC1RAB9ACES2CES1 | |
| SCHEMBL4620575 | 0.83 | CA1 (0.47) | PARP1CES2CES1SMN1; SMN2MMP2 | |
| SCHEMBL4622173 | 0.83 | CA1 (0.47) | PARP1CES2CES1SMN1; SMN2MMP2 | |
| SCHEMBL4621268 | 0.83 | CA1 (0.47) | PARP1CES2CES1SMN1; SMN2MMP2 | |
| SCHEMBL4620791 | 0.81 | ADAMTS4 (0.53) | SMN1; SMN2MMP2KMT2APOLBMAPT | |
| SCHEMBL4620829 | 0.81 | ADAMTS4 (0.53) | SMN1; SMN2MMP2KMT2APOLBMAPT |
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-1884230-A1 | PARAKERATOSIS INHIBITOR, PORE-SHRINKING AGENT OR AGENT FOR PREVENTING/AMELIORATING ROUGH SKIN AND EXTERNAL COMPOSITION FOR SKIN | Shiseido Company, Limited (JP) | 2008-02-06 | — | — | EP | disclosed |