Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.50 |
| ▸ | BCHE | P06276 | 3/20 | 0.48 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.46 |
| ▸ | CDK1 | P06493 | 1/20 | 0.46 |
| ▸ | CDK4 | P11802 | 1/20 | 0.46 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.46 |
| ▸ | CCND1 | P24385 | 1/20 | 0.46 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.46 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.43 |
| ▸ | TLR4 | O00206 | 1/20 | 0.43 |
| ▸ | TLR2 | O60603 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27795629 | 0.87 | MAOB (0.45) | MAOBMAOABCHECYP4F2CYP4A11 | |
| SCHEMBL25423790 | 0.87 | MAOB (0.49) | MAOBMAOABCHECCNB2CDK1 | |
| SCHEMBL1009475 | 0.84 | MAOB (0.68) | MAOBMAOABCHECCNB2CDK1 | |
| SCHEMBL27795625 | 0.84 | TDP1 (0.46) | MAOBMAOABCHECYP4F2CYP4A11 | |
| SCHEMBL2206728 | 0.84 | MAOA (0.73) | MAOBMAOACCNB2CDK1CDK4 | |
| SCHEMBL27795581 | 0.83 | TDP1 (0.48) | MAOBMAOABCHECYP4F2CYP4A11 | |
| SCHEMBL3926767 | 0.82 | MAOB (0.50) | MAOBBCHECYP4F2CYP4A11F2 | |
| SCHEMBL2207662 | 0.81 | MAOA (0.73) | MAOBMAOACCNB2CDK1CDK4 | |
| SCHEMBL2206938 | 0.80 | MAOA (0.71) | MAOBMAOACCNB2CDK1CDK4 | |
| SCHEMBL7775043 | 0.80 | KDM4E (0.42) | MAOBMAOABCHEDRD2DRD4 |
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-2555625-A1 | PROCESS FOR PREPARING BENZOXABOROLES | GlaxoSmithKline LLC (US) | 2013-02-13 | — | — | EP | disclosed |
| WO-2011127143-A1 | PROCESS FOR PREPARING BENZOXABOROLES | GLAXOSMITHKLINE LLC (US) | 2011-10-13 | — | — | WO | disclosed |