Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.41 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4336440 | 0.85 | CYP2D6 (0.41) | KMT2AMEN1RAB9AKDM4EALDH1A1 | |
| SCHEMBL12679227 | 0.84 | SCN9A (0.44) | KMT2AMEN1RAB9AKDM4EALDH1A1 | |
| SCHEMBL3506831 | 0.82 | POLB (0.44) | KMT2AMEN1RAB9AKDM4EALDH1A1 | |
| SCHEMBL4381682 | 0.81 | KMT2A (0.43) | KMT2AMEN1RAB9AKDM4EALDH1A1 | |
| SCHEMBL4583413 | 0.80 | KMT2A (0.50) | KMT2AMEN1RAB9AALDH1A1CYP3A4 | |
| SCHEMBL5551458 | 0.79 | PLA2G1B (0.47) | KMT2AMEN1RAB9AKDM4EALDH1A1 | |
| SCHEMBL4374776 | 0.78 | CYP3A4 (0.48) | KMT2ARAB9AKDM4EALDH1A1PLA2G1B | |
| SCHEMBL4728727 | 0.69 | ATM (0.50) | POLB | |
| SCHEMBL13260263 | 0.69 | ATM (0.45) | RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL683030 | 0.69 | CTSS (0.52) | ALDH1A1HPGDHTTTSHRLMNA |
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-2117523-A1 | INHIBITORS OF AKT ACTIVITY | SmithKline Beecham Corporation (US) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008098104-A1 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2008-08-14 | — | — | WO | disclosed |