Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 4/20 | 0.57 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 4/20 | 0.40 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GPR17 | Q13304 | 1/20 | 0.38 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | MAP2 | P11137 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14604008 | 0.90 | MAPK8 (0.48) | GRIN1MCL1MAPK8 | |
| SCHEMBL14604229 | 0.86 | MAPK8 (0.49) | GRIN1MAPK8 | |
| SCHEMBL14604103 | 0.85 | MAPK8 (0.51) | GRIN1MAPK8 | |
| SCHEMBL14604210 | 0.85 | MAPK8 (0.51) | GRIN1MAPK8 | |
| SCHEMBL14604194 | 0.84 | MAPK8 (0.51) | SMN1; SMN2MAPK8 | |
| SCHEMBL14604243 | 0.84 | MAPK8 (0.51) | GRIN1MAPK8 | |
| SCHEMBL14604039 | 0.84 | MAPK8 (0.51) | GRIN1MAPK8 | |
| SCHEMBL14604023 | 0.84 | MAPK8 (0.53) | GRIN1SMN1; SMN2MAPK8 | |
| SCHEMBL14604164 | 0.83 | MAPK8 (0.54) | GRIN1MAPK8 | |
| SCHEMBL14604228 | 0.83 | MAPK8 (0.54) | SMN1; SMN2MAPK8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2731932-A1 | AMINOMETHYL QUINOLONE COMPOUNDS | F.HOFFMANN-LA ROCHE AG (CH) | 2014-05-21 | — | — | EP | claimed |
| WO-2013007676-A1 | AMINOMETHYL QUINOLONE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2013-01-17 | — | — | WO | claimed |