Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | MAOA | P21397 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17196260 | 0.82 | ALOX5 (0.58) | ALOX5ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL2954355 | 0.82 | MAOA (0.47) | ALOX5ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL7035976 | 0.80 | ALDH1A1 (0.43) | ALOX5ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL754169 | 0.80 | ALDH1A1 (0.43) | ALOX5ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL13201404 | 0.80 | ALDH1A1 (0.43) | ALOX5ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL9425618 | 0.80 | MAOA (0.48) | ALOX5ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL24828780 | 0.77 | ADRB2 (0.42) | ALDH1A1KDM4EHPGDMAPTMAOA | |
| SCHEMBL8521819 | 0.77 | MAOA (0.41) | ALDH1A1KDM4EHPGDMAPTMAOA | |
| SCHEMBL15663291 | 0.77 | KDM4E (0.59) | ALOX5ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL19772857 | 0.76 | GABRA1 (0.46) | ALDH1A1KDM4EHPGDMAPTMAOA |
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-2018016742-A1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2018-01-25 | — | — | WO | disclosed |