Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AQP1 | P29972 | 3/20 | 0.49 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 3/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.32 |
| ▸ | FPR1 | P21462 | 1/20 | 0.32 |
| ▸ | FPR2 | P25090 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3207566 | 1.00 | AQP1 (0.49) | AQP1HTR1AHSP90AA1HSP90AB1MAOB | |
| SCHEMBL3211367 | 1.00 | AQP1 (0.49) | AQP1HTR1AHSP90AA1HSP90AB1MAOB | |
| SCHEMBL3213649 | 0.89 | AQP1 (0.39) | AQP1HTR1AMAOBSLC6A2SLC6A4 | |
| SCHEMBL3204608 | 0.89 | AQP1 (0.39) | AQP1HTR1AMAOBSLC6A2SLC6A4 | |
| SCHEMBL3205840 | 0.89 | AQP1 (0.39) | AQP1HTR1AMAOBSLC6A2SLC6A4 | |
| SCHEMBL3216316 | 0.87 | AQP1 (0.39) | AQP1HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3215986 | 0.87 | AQP1 (0.39) | AQP1HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3216433 | 0.87 | AQP1 (0.39) | AQP1HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3208352 | 0.86 | AQP1 (0.66) | AQP1MAPK14 | |
| SCHEMBL3208259 | 0.86 | AQP1 (0.66) | AQP1MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008052075-A2 | BENZOXAZINE DERIVATIVES AND USES THEREOF | WYETH (US) | 2008-05-02 | — | — | WO | claimed |
| WO-2008052075-A2 | BENZOXAZINE DERIVATIVES AND USES THEREOF | WYETH (US) | 2008-05-02 | — | — | WO | disclosed |