Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSPO | P30536 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | IL1R1 | P14778 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | COMT | P21964 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.30 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23760193 | 0.94 | L3MBTL1 (0.40) | TSPOL3MBTL1KDM4EATMIL1R1 | |
| SCHEMBL23760195 | 0.86 | L3MBTL1 (0.41) | L3MBTL1KDM4EATMIL1R1ALDH1A1 | |
| SCHEMBL23760127 | 0.84 | IL1R1 (0.43) | L3MBTL1KDM4EATMIL1R1ALDH1A1 | |
| SCHEMBL22036324 | 0.83 | ATM (0.41) | TSPOL3MBTL1KDM4EATMIL1R1 | |
| SCHEMBL23760174 | 0.82 | ALDH1A1 (0.37) | L3MBTL1KDM4EATMIL1R1ALDH1A1 | |
| SCHEMBL21578517 | 0.79 | ATM (0.57) | TSPOL3MBTL1KDM4EATMIL1R1 | |
| SCHEMBL21152042 | 0.79 | ATM (0.57) | TSPOL3MBTL1KDM4EATMIL1R1 | |
| SCHEMBL21531868 | 0.79 | ATM (0.57) | TSPOL3MBTL1KDM4EATMIL1R1 | |
| SCHEMBL18680581 | 0.79 | ATM (0.57) | TSPOL3MBTL1KDM4EATMIL1R1 | |
| SCHEMBL14805601 | 0.79 | ATM (0.57) | TSPOL3MBTL1KDM4EATMIL1R1 |
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-3630764-B1 | HEXACYCLIC HETEROAROMATIC COMPOUNDS FOR USE IN ELEKTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2021-08-18 | — | — | EP | disclosed |