Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.38 |
| ▸ | TOP2A | P11388 | 1/20 | 0.38 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.33 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL8975983 | 0.89 | MAOA (0.43) | ADORA3ADORA2ATOP2AKDM4EMEN1 | |
| SCHEMBL1609661 | 0.79 | ADORA3 (0.54) | ADORA3ADORA2AROCK2TOP2ANFATC1 | |
| SCHEMBL12464502 | 0.79 | ADORA3 (0.50) | ADORA3ADORA2AROCK2TOP2ANFATC1 | |
| SCHEMBL12464501 | 0.78 | MAPT (0.45) | ADORA3ADORA2AROCK2TOP2ANFATC1 | |
| SCHEMBL29355852 | 0.78 | ROCK2 (0.46) | ADORA3ADORA2AROCK2TOP2ANFATC1 | |
| SCHEMBL2722137 | 0.78 | ADORA3 (0.46) | ADORA3ADORA2AROCK2TOP2ANFATC1 | |
| SCHEMBL16592460 | 0.78 | ROCK2 (0.46) | ADORA3ADORA2AROCK2TOP2ANFATC1 | |
| SCHEMBL9968101 | 0.76 | ADORA3 (0.44) | ADORA3ADORA2AROCK2TOP2ANFATC1 | |
| SCHEMBL2628358 | 0.76 | ADORA3 (0.49) | ADORA3ADORA2AROCK2TOP2ANFATC1 | |
| SCHEMBL12464614 | 0.75 | MAPT (0.64) | ADORA3ADORA2AROCK2DYRK1AKDM4E |
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-5532261-A | TREATING STAPHYLOCOCCUS INFECTIONS | MERCK & CO., INC. (US) | 1996-07-02 | — | — | US | disclosed |