Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 5/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27759268 | 0.85 | HRH3 (0.40) | KCNH2CYP3A4CYP2D6LMNAKCNK3 | |
| SCHEMBL27780650 | 0.81 | GAA (0.37) | LMNAKCNK3PIK3CDHRH3ELANE | |
| SCHEMBL27759292 | 0.76 | HRH3 (0.42) | KCNH2CYP3A4LMNAPIK3CDHRH3 | |
| SCHEMBL27759300 | 0.76 | HRH3 (0.42) | KCNH2PIK3CDHRH3 | |
| SCHEMBL27780676 | 0.76 | TNF (0.42) | KCNH2LMNAKCNK3PIK3CDHRH3 | |
| SCHEMBL27780703 | 0.75 | USP2 (0.37) | KCNH2CYP3A4CYP2D6LMNAKCNK3 | |
| SCHEMBL27759279 | 0.74 | LMNA (0.31) | LMNA | |
| SCHEMBL28030923 | 0.73 | HDAC1 (0.38) | LMNAHTR1APIK3CDELANECNR2 | |
| SCHEMBL24113864 | 0.66 | PIK3CD (0.39) | LMNAHTR1APIK3CDELANESMN1; SMN2 | |
| SCHEMBL7421353 | 0.65 | PPARG (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101535291-A | 5-substituted quinazolinone derivatives as antitumor agents | CELGENE CORP (US) | 2009-09-16 | — | — | CN | disclosed |