Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 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 | |
|---|---|---|---|---|
| SCHEMBL3393860 | 0.87 | ADORA2A (0.38) | ADORA2AADORA1LMNA | |
| SCHEMBL15434656 | 0.85 | KDM4E (0.39) | KDM4EALDH1A1LMNA | |
| SCHEMBL8513097 | 0.83 | ADORA2A (0.36) | KDM4EADORA2AADORA1NPSR1NR1I2 | |
| SCHEMBL9203918 | 0.82 | ADORA2A (0.35) | KDM4EADORA2AADORA1NPSR1NR1I2 | |
| SCHEMBL6026297 | 0.79 | KMT2A (0.36) | KDM4EADORA2AADORA1ALDH1A1KMT2A | |
| SCHEMBL9286811 | 0.77 | NPSR1 (0.39) | KDM4EADORA2AADORA1NPSR1ALDH1A1 | |
| SCHEMBL15504772 | 0.76 | ADORA2A (0.32) | ADORA2AADORA1 | |
| SCHEMBL13823338 | 0.74 | NPSR1 (0.35) | KDM4ENPSR1 | |
| SCHEMBL12495771 | 0.73 | ADORA2A (0.40) | KDM4EADORA2AADORA1 | |
| SCHEMBL15429583 | 0.73 | ALDH1A1 (0.31) | KDM4EALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012071511-A1 | BENZOXAZEPINES AS INHIBITORS OF MTOR AND METHODS OF THEIR USE AND MANUFACTURE | EXELIXIS, INC. (US) | 2012-05-31 | — | — | WO | disclosed |