Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 3/20 | 0.50 |
| ▸ | MAP3K14 | Q99558 | 7/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 1/20 | 0.36 |
| ▸ | LTK | P29376 | 1/20 | 0.36 |
| ▸ | GRK5 | P34947 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | CLK2 | P49760 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL988982 | 0.88 | NOTUM (0.39) | NOTUMPIK3CDPIK3CAPIK3CBLMNA | |
| SCHEMBL989938 | 0.86 | ALDH1A1 (0.41) | NOTUMMAP3K14PIK3CDPIK3R1LMNA | |
| SCHEMBL4055690 | 0.83 | LMNA (0.36) | NOTUMPIK3CDPIK3CAPIK3CBLMNA | |
| SCHEMBL988463 | 0.82 | NOTUM (0.70) | NOTUMMAP3K14PIK3CAPIK3CB | |
| SCHEMBL989371 | 0.81 | KDM4E (0.41) | LMNAMAPTMEN1NPC1RAB9A | |
| SCHEMBL1516838 | 0.78 | SRD5A1 (0.38) | NOTUMLMNAMAPTHTTBLM | |
| SCHEMBL988065 | 0.77 | THRB (0.42) | LMNAMAPTMEN1NPC1RAB9A | |
| SCHEMBL1484975 | 0.77 | MAP3K14 (0.63) | MAP3K14PIK3CDPIK3R1PIK3CA | |
| SCHEMBL989483 | 0.74 | NOTUM (0.70) | NOTUMMAP3K14PIK3CDPIK3CAPIK3CB | |
| SCHEMBL1516804 | 0.74 | NOTUM (0.44) | NOTUMMAP3K14PIK3CDPIK3R1PNMT |
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 |