Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 2/20 | 0.33 |
| ▸ | DRD5 | P21918 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.33 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.31 |
| ▸ | HTT | P42858 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18568854 | 0.92 | KDM4E (0.40) | L3MBTL1KDM4EATMHDAC4 | |
| SCHEMBL18678288 | 0.87 | NR1I2 (0.31) | HTTDCTPP1 | |
| SCHEMBL21388324 | 0.87 | KDM4E (0.36) | L3MBTL1KDM4EATMHDAC4 | |
| SCHEMBL20707565 | 0.85 | KDM4E (0.40) | L3MBTL1KDM4EATMHDAC4 | |
| SCHEMBL13903725 | 0.85 | KDM4E (0.37) | AKR1C4AKR1C3AKR1C2AKR1C1L3MBTL1 | |
| SCHEMBL22383912 | 0.85 | KDM4E (0.31) | L3MBTL1KDM4EATMHDAC4 | |
| SCHEMBL20709291 | 0.82 | KDM4E (0.33) | AKR1C4AKR1C3AKR1C2AKR1C1L3MBTL1 | |
| SCHEMBL23472967 | 0.81 | KDM4E (0.37) | L3MBTL1KDM4EATMHDAC4MEN1 | |
| SCHEMBL19003203 | 0.81 | KDM4E (0.37) | L3MBTL1KDM4EATM | |
| SCHEMBL19774408 | 0.81 | KDM4E (0.37) | L3MBTL1KDM4EATM |
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-3357912-A1 | SPIRO COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME | LG Chem, Ltd. (KR) | 2018-08-08 | — | — | EP | disclosed |