Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 5/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.67 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.67 |
| ▸ | MAPT | P10636 | 4/20 | 0.67 |
| ▸ | GLA | P06280 | 3/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | GAA | P10253 | 3/20 | 0.67 |
| ▸ | HPGD | P15428 | 3/20 | 0.67 |
| ▸ | STAT3 | P40763 | 2/20 | 0.67 |
| ▸ | CASP1 | P29466 | 2/20 | 0.67 |
| ▸ | CASP7 | P55210 | 2/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.67 |
| ▸ | HTT | P42858 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.67 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.60 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.56 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.51 |
| ▸ | THRB | P10828 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL12719328 | 0.78 | NOTUM (0.78) | TP53KDM4EMAPK1MAPTGLA | |
| SCHEMBL991022 | 0.77 | NOTUM (0.70) | TP53KDM4EMAPK1MAPTGLA | |
| SCHEMBL989730 | 0.76 | NOTUM (1.00) | TP53KDM4EMAPK1MAPTGLA | |
| SCHEMBL990557 | 0.76 | NOTUM (0.80) | TP53KDM4EMAPK1MAPTGLA | |
| SCHEMBL989700 | 0.76 | NOTUM (0.64) | TP53KDM4EMAPK1MAPTGLA | |
| SCHEMBL20597454 | 0.75 | KDM4E (0.70) | TP53KDM4EMAPK1MAPTGLA | |
| SCHEMBL991058 | 0.75 | NOTUM (0.78) | TP53KDM4EMAPK1MAPTGLA | |
| SCHEMBL19150001 | 0.75 | MAPT (0.44) | TP53KDM4EMAPK1MAPTGLA | |
| SCHEMBL989075 | 0.74 | MAPT (0.67) | TP53KDM4EMAPK1MAPTGLA | |
| SCHEMBL989341 | 0.74 | NOTUM (0.64) | TP53KDM4EMAPK1MAPTGLA |
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-2276767-A1 | BENZOPYRAN AND BENZOXEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | Genentech, Inc. (US) | 2011-01-26 | — | — | EP | disclosed |
| WO-2009123971-A1 | BENZOPYRAN AND BENZOXEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | GENENTECH, INC. (US) | 2009-10-08 | — | — | WO | disclosed |