Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.51 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CTSA | P10619 | 4/20 | 0.39 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.38 |
| ▸ | MME | P08473 | 1/20 | 0.36 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4596259 | 0.83 | CNR2 (0.43) | ADRB2ADRB1HIF1ACTSAMME | |
| SCHEMBL4595044 | 0.81 | RIPK1 (0.45) | AOC3MMEACE | |
| SCHEMBL4596291 | 0.81 | RIPK1 (0.45) | AOC3MMEACE | |
| SCHEMBL4389472 | 0.81 | RIPK1 (0.45) | AOC3MMEACE | |
| SCHEMBL4595990 | 0.77 | AOC3 (0.43) | CYP2D6AOC3KMT2A | |
| SCHEMBL4595463 | 0.76 | ADRB3 (0.44) | ADRB2ADRB1CYP2D6KMT2A | |
| SCHEMBL4595555 | 0.75 | POLB (0.39) | CTSA | |
| SCHEMBL1529699 | 0.72 | NPC1 (0.45) | BLMMMEACEKMT2A | |
| SCHEMBL2532623 | 0.72 | TDP1 (0.44) | ADRB2NFKB1HIF1ABLMMME | |
| SCHEMBL836126 | 0.72 | ADRB2 (0.44) | ADRB2ADRB1CYP2D6NFKB1HIF1A |
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-1874768-A2 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006113837-A2 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2006-10-26 | — | — | WO | disclosed |