Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | PIK3CA | P42336 | 11/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.54 |
| ▸ | MTOR | P42345 | 3/20 | 0.54 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.54 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3878007 | 0.87 | HTT (0.61) | MAPTCYP1A2HTTCYP2D6PIK3CA | |
| SCHEMBL1029661 | 0.85 | HTT (0.80) | ATRMAPTCYP1A2HTTCYP2D6 | |
| SCHEMBL4139135 | 0.85 | PIK3CA (0.74) | MAPTCYP1A2HTTCYP2D6PIK3CA | |
| SCHEMBL1263306 | 0.85 | ATR (0.60) | ATRMAPTHTTPIK3CANPSR1 | |
| SCHEMBL4934392 | 0.81 | PIK3CA (0.66) | MAPTHTTPIK3CANPSR1TSHR | |
| SCHEMBL4128517 | 0.81 | CYP1A2 (0.61) | ATRMAPTCYP1A2HTTCYP2D6 | |
| SCHEMBL1309606 | 0.80 | PIK3CA (0.68) | ATRHTTPIK3CANPSR1PIK3CG | |
| SCHEMBL1029078 | 0.80 | PIK3CA (0.63) | MAPTCYP1A2HTTCYP2D6PIK3CA | |
| SCHEMBL1263031 | 0.80 | MAPT (0.54) | ATRMAPTCYP1A2HTTCYP2D6 | |
| SCHEMBL4604779 | 0.79 | PIK3CA (0.63) | ATRMAPTCYP1A2HTTPIK3CA |
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-2010120994-A2 | UREIDOARYL-AND CARBAMOYLARYL-MORPHOLINO- PYRIMIDINE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESIS | WYETH LLC (US) | 2010-10-21 | — | — | WO | disclosed |