Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 4/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL989471 | 0.87 | NOTUM (0.34) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL989459 | 0.86 | PIK3CA (0.34) | NOTUMPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL15200696 | 0.84 | RAB9A (0.33) | PIK3CDPIK3CAPIK3CBPIK3CGRAB9A | |
| SCHEMBL988657 | 0.81 | NPC1 (0.35) | PIK3CDPIK3CAPIK3CBPIK3CGRAB9A | |
| SCHEMBL989505 | 0.80 | PIK3CA (0.35) | PIK3CDPIK3CAPIK3CBPIK3CGLMNA | |
| SCHEMBL1516787 | 0.78 | PRMT5 (0.34) | NOTUMPIK3CAMAOBLMNAGPR183 | |
| SCHEMBL988493 | 0.77 | PRMT5 (0.35) | MAOBLMNAMAPTHTTBLM | |
| SCHEMBL1516828 | 0.77 | MMP2 (0.30) | — | |
| SCHEMBL1516817 | 0.76 | PRMT5 (0.34) | MAOBLMNAMAPTHTTBLM | |
| SCHEMBL989428 | 0.74 | TAS1R3 (0.41) | PIK3CAPIK3CBRAB9ANPC1LMNA |
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 |