Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 3/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | VDR | P11473 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13782202 | 0.84 | HDAC1 (0.38) | HDAC1HDAC2PTGS1PTGS2SLC6A2 | |
| SCHEMBL20463238 | 0.78 | PTGS1 (0.49) | PTGS1PTGS2 | |
| SCHEMBL13782245 | 0.78 | OGG1 (0.36) | HDAC1HDAC2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL18067605 | 0.75 | HDAC1 (0.40) | HDAC1HDAC2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL515423 | 0.74 | ATM (0.48) | HDAC1HDAC2 | |
| SCHEMBL515424 | 0.74 | ATM (0.48) | HDAC1HDAC2 | |
| SCHEMBL6027480 | 0.74 | ATM (0.48) | HDAC1HDAC2 | |
| SCHEMBL2209426 | 0.74 | HDAC1 (0.51) | HDAC1HDAC2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL24250357 | 0.74 | ACHE (0.47) | PTGS1PTGS2VDR | |
| SCHEMBL21556465 | 0.74 | MAPT (0.44) | HDAC2PTGS1PTGS2TP53BP1THPO |
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-2075309-A2 | Novel organic electroluminescent compounds and organic electroluminescent device using the same | Gracel Display Inc. (KR) | 2009-07-01 | — | — | EP | disclosed |