Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | TLR8 | Q9NR97 | 11/20 | 0.45 |
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL6416413 | 0.90 | TLR8 (0.56) | NPSR1TLR8TLR7 | |
| SCHEMBL12495467 | 0.87 | KDM4E (0.43) | NPSR1TLR8TLR7KDM4EHPGD | |
| SCHEMBL4986988 | 0.87 | TLR8 (0.55) | NPSR1TLR8TLR7 | |
| SCHEMBL6419045 | 0.87 | TLR8 (0.55) | NPSR1TLR8TLR7 | |
| SCHEMBL9203920 | 0.86 | NPSR1 (0.49) | NPSR1TLR8TLR7KDM4EHPGD | |
| SCHEMBL9286486 | 0.85 | TLR8 (0.52) | TLR8TLR7 | |
| SCHEMBL3458103 | 0.83 | NPSR1 (0.50) | NPSR1TLR8TLR7KDM4EHPGD | |
| SCHEMBL6416089 | 0.79 | NPSR1 (0.51) | NPSR1TLR8TLR7KDM4EHPGD | |
| SCHEMBL12496379 | 0.79 | TLR8 (0.47) | NPSR1TLR8TLR7KDM4EHPGD | |
| SCHEMBL857121 | 0.79 | PDK2 (0.43) | KDM4EHPGDSMN1; SMN2ALDH1A1 |
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-2643315-A1 | BENZOXAZEPINES AS INHIBITORS OF P13K/mTOR AND METHODS OF THEIR USE AND MANUFACTURE | Exelixis, Inc. (US) | 2013-10-02 | — | — | EP | disclosed |
| WO-2012074869-A1 | BENZOXAZEPINES AS INHIBITORS OF PI3K/MTOR AND METHODS OF THEIR USE AND MANUFACTURE | EXELIXIS, INC. (US) | 2012-06-07 | — | — | WO | disclosed |
| WO-2012071511-A1 | BENZOXAZEPINES AS INHIBITORS OF MTOR AND METHODS OF THEIR USE AND MANUFACTURE | EXELIXIS, INC. (US) | 2012-05-31 | — | — | WO | disclosed |
| WO-2012071501-A1 | BENZOXAZEPINES ASN INHIBITORS OF P13K/M TOR AND METHODS OF THEIR USE AND MANUFACTURE | EXELIXIS, INC. (US) | 2012-05-31 | — | — | WO | disclosed |