Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HNF4A | P41235 | 3/20 | 0.50 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.49 |
| ▸ | FABP3 | P05413 | 1/20 | 0.46 |
| ▸ | FABP4 | P15090 | 1/20 | 0.46 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.46 |
| ▸ | CDC25B | P30305 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | BRS3 | P32247 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | FNTA | P49354 | 1/20 | 0.45 |
| ▸ | FNTB | P49356 | 1/20 | 0.45 |
| ▸ | LTB4R2 | Q9NPC1 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL505412 | 0.86 | HNF4A (0.64) | HNF4ABCAT2FABP3FABP4FABP5 | |
| SCHEMBL32677772 | 0.86 | HNF4A (0.64) | HNF4ABCAT2FABP3FABP4FABP5 | |
| SCHEMBL32677769 | 0.86 | HNF4A (0.64) | HNF4ABCAT2FABP3FABP4FABP5 | |
| Biphenyl SCHEMBL9292498 | 0.84 | HNF4A (0.67) | HNF4ABCAT2FABP3FABP4FABP5 | |
| SCHEMBL11554621 | 0.84 | HNF4A (0.61) | HNF4ABCAT2FABP3FABP4FABP5 | |
| SCHEMBL4538108 | 0.82 | PTGS2 (0.61) | CHRNB2CHRNA4PTGS2SRC | |
| SCHEMBL133057 | 0.82 | HNF4A (0.69) | HNF4ABCAT2FABP3FABP4FABP5 | |
| SCHEMBL18759613 | 0.82 | HNF4A (0.63) | HNF4ABCAT2FABP3FABP4FABP5 | |
| SCHEMBL30292805 | 0.82 | HNF4A (0.63) | HNF4ABCAT2FABP3FABP4FABP5 | |
| Benzene SCHEMBL1403559 | 0.82 | HNF4A (0.69) | HNF4ABCAT2FABP3FABP4FABP5 |
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-2013210-A1 | PURINE DERIVATIVES WITH ACTIVITY TO THE ADENOSINE A2A RECEPTOR | Novartis Ag (CH) | 2009-01-14 | — | — | EP | disclosed |
| WO-2007121919-A1 | PURINE DERIVATIVES WITH ACTIVITY TO THE ADENOSINE A2A RECEPTOR | NOVARTIS AG (CH) | 2007-11-01 | — | — | WO | disclosed |