Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 8/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 10/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 10/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 10/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 9/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 8/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 8/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7368769 | 0.81 | LRRK2 (0.34) | LRRK2 | |
| SCHEMBL6800532 | 0.75 | GABRG2 (0.65) | LRRK2KDM4EALDH1A1POLBRXFP1 | |
| SCHEMBL7458508 | 0.75 | GABRG2 (0.67) | LRRK2KDM4EALDH1A1POLBRXFP1 | |
| SCHEMBL7455903 | 0.73 | GABRA1 (0.67) | LRRK2KDM4EALDH1A1POLBRXFP1 | |
| SCHEMBL23111604 | 0.72 | LRRK2 (0.60) | LRRK2KDM4EALDH1A1POLBRXFP1 | |
| SCHEMBL7462795 | 0.72 | GABRG2 (0.69) | LRRK2KDM4EALDH1A1POLBRXFP1 | |
| SCHEMBL12498119 | 0.70 | LRRK2 (0.60) | LRRK2KDM4EALDH1A1POLBRXFP1 | |
| SCHEMBL6799646 | 0.68 | KDM4E (0.60) | LRRK2KDM4EALDH1A1POLBRXFP1 | |
| SCHEMBL25625612 | 0.65 | ALDH1A1 (0.57) | LRRK2KDM4EALDH1A1POLBRXFP1 | |
| SCHEMBL1060812 | 0.64 | KDM4E (1.00) | LRRK2KDM4EALDH1A1POLBRXFP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0937072-B1 | THIENYLCYCLOHEXANONE DERIVATIVES AS LIGANDS OF THE GABA A alpha5 RECEPTOR SUBTYPE | MERCK SHARP & DOHME (GB) | 2002-01-09 | — | — | EP | claimed |
| US-6262103-B1 | ALZHEIMER'S DISEASE. | MERCK SHARP & DOHME LIMITED (GB) | 2001-07-17 | — | — | US | claimed |
| EP-0937072-B1 | THIENYLCYCLOHEXANONE DERIVATIVES AS LIGANDS OF THE GABA A alpha5 RECEPTOR SUBTYPE | MERCK SHARP & DOHME (GB) | 2002-01-09 | — | — | EP | disclosed |
| US-6262103-B1 | ALZHEIMER'S DISEASE. | MERCK SHARP & DOHME LIMITED (GB) | 2001-07-17 | — | — | US | disclosed |