Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 11/20 | 0.38 |
| ▸ | KIT | P10721 | 2/20 | 0.31 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL859033 | 0.96 | PIK3CA (0.38) | PIK3CAKITCREBBPPDE10AMTOR | |
| SCHEMBL855888 | 0.93 | PIK3CA (0.39) | PIK3CAKITCREBBPPDE10AMTOR | |
| SCHEMBL856929 | 0.88 | PIK3CA (0.37) | PIK3CAKITCREBBPPDE10A | |
| SCHEMBL858788 | 0.88 | PIK3CA (0.41) | PIK3CAKITCREBBPMTOR | |
| SCHEMBL856138 | 0.86 | PIK3CA (0.40) | PIK3CAKITCREBBPMTOR | |
| SCHEMBL8877512 | 0.86 | PIK3CA (0.40) | PIK3CAKITCREBBPMTOR | |
| SCHEMBL857336 | 0.85 | PIK3CA (0.48) | PIK3CAKITCREBBP | |
| SCHEMBL857891 | 0.85 | PIK3CA (0.37) | PIK3CAKITCREBBPPDE10AMTOR | |
| SCHEMBL857832 | 0.85 | PIK3CA (0.39) | PIK3CAKITCREBBPPDE10AMTOR | |
| SCHEMBL859032 | 0.85 | PIK3CA (0.39) | PIK3CAKITCREBBPMTOR |
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-2432779-A1 | BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES | Exelixis, Inc. (US) | 2012-03-28 | — | — | EP | disclosed |
| WO-2010135524-A1 | BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES | EXELIXIS, INC. (US) | 2010-11-25 | — | — | WO | disclosed |