Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | FGFR2 | P21802 | 3/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.39 |
| ▸ | SELE | P16581 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21480279 | 0.87 | ALDH1A1 (0.48) | ALDH1A1RAB9AHPGDMAPTNPC1 | |
| SCHEMBL23633176 | 0.84 | ALDH1A1 (0.46) | ALDH1A1RAB9AHPGDMAPTNPC1 | |
| SCHEMBL25586333 | 0.81 | MAPT (0.43) | ALDH1A1RAB9AHPGDMAPTNPC1 | |
| SCHEMBL13580946 | 0.78 | ALOX15 (0.47) | ALDH1A1RAB9AHPGDMAPTNPC1 | |
| SCHEMBL27109839 | 0.77 | SLC6A4 (0.45) | ALDH1A1MAPK1SLC6A4TSHRGAA | |
| SCHEMBL11608881 | 0.77 | MAPT (0.63) | ALDH1A1RAB9AHPGDMAPTNPC1 | |
| SCHEMBL27018957 | 0.76 | RAB9A (0.53) | ALDH1A1RAB9AHPGDMAPTNPC1 | |
| SCHEMBL13580943 | 0.75 | SLC6A4 (0.46) | ALDH1A1RAB9AHPGDMAPTNPC1 | |
| SCHEMBL13580771 | 0.74 | ALDH1A1 (0.42) | ALDH1A1RAB9AHPGDMAPTNPC1 | |
| SCHEMBL26256982 | 0.74 | MAPT (0.50) | ALDH1A1RAB9AHPGDMAPTNPC1 |
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-2021141370-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME | 경상국립대학교산학협력단 | 2021-07-15 | — | — | WO | disclosed |