Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | CRHBP | P24387 | 2/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22336468 | 1.00 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1TDP1CYP3A4KDM4E | |
| SCHEMBL15595154 | 1.00 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1TDP1CYP3A4KDM4E | |
| SCHEMBL21468608 | 1.00 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1TDP1CYP3A4KDM4E | |
| SCHEMBL5858491 | 0.97 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1TDP1CYP3A4KDM4E | |
| SCHEMBL12936130 | 0.97 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1TDP1CYP3A4KDM4E | |
| SCHEMBL2391573 | 0.94 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1TDP1CYP3A4KDM4E | |
| SCHEMBL2383757 | 0.94 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1TDP1CYP3A4KDM4E | |
| SCHEMBL332348 | 0.94 | ALDH1A1 (0.57) | ALDH1A1L3MBTL1TDP1CYP3A4KDM4E | |
| SCHEMBL15595125 | 0.94 | ALDH1A1 (0.57) | ALDH1A1L3MBTL1TDP1CYP3A4KDM4E | |
| SCHEMBL15595167 | 0.91 | ALDH1A1 (0.62) | ALDH1A1L3MBTL1TDP1CYP3A4KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-20210399227-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE AND FUSED POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2021-12-23 | — | — | US | disclosed |