Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CHKA | P35790 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22827618 | 0.83 | TSHR (0.43) | ALDH1A1TDP1MAPTHTTKDM4E | |
| SCHEMBL23485009 | 0.78 | ALDH1A1 (0.42) | ALDH1A1TDP1MAPTHTTKDM4E | |
| SCHEMBL28043798 | 0.76 | CHKA (0.40) | ALDH1A1TDP1MAPTHTTKDM4E | |
| SCHEMBL27760190 | 0.75 | ALDH1A1 (0.35) | ALDH1A1TDP1MAPTHTTKDM4E | |
| SCHEMBL19801926 | 0.73 | ALDH1A1 (0.39) | ALDH1A1TDP1MAPTHTTKDM4E | |
| SCHEMBL22180142 | 0.73 | AHR (0.41) | ALDH1A1TDP1 | |
| SCHEMBL22326328 | 0.73 | MAPT (0.46) | ALDH1A1TDP1MAPTHTTKDM4E | |
| SCHEMBL13714194 | 0.73 | ALDH1A1 (0.41) | ALDH1A1TDP1MAPTHTTKDM4E | |
| SCHEMBL17370152 | 0.73 | ALDH1A1 (0.46) | ALDH1A1TDP1MAPTHTTKDM4E | |
| SCHEMBL19801901 | 0.72 | ALDH1A1 (0.38) | ALDH1A1TDP1MAPTHTTKDM4E |
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-3753995-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE AND COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE | Samsung Display Co., Ltd. (KR) | 2020-12-23 | — | — | EP | disclosed |