Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 1/20 | 0.51 |
| ▸ | BRD4 | O60885 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | RAF1 | P04049 | 1/20 | 0.42 |
| ▸ | BRAF | P15056 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 6/20 | 0.40 |
| ▸ | STK17B | O94768 | 1/20 | 0.40 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PRKDC | P78527 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13119749 | 0.89 | AKT1 (0.51) | AKT1BRD4KMT2AMAPTLMNA | |
| SCHEMBL13119769 | 0.79 | SMN1; SMN2 (0.43) | AKT1KMT2AMAPTCYP1A2CYP2D6 | |
| SCHEMBL3603746 | 0.78 | ATR (0.49) | AKT1PRKDC | |
| SCHEMBL2073168 | 0.77 | KMT2A (0.51) | KMT2AMAPTCYP1A2CYP2D6RAF1 | |
| SCHEMBL3610408 | 0.77 | RECQL (0.47) | KMT2AMAPTLMNAKDM4EMEN1 | |
| SCHEMBL3988105 | 0.77 | ALDH1A1 (0.53) | AKT1BRD4MAPTSTK17BSTK17A | |
| SCHEMBL24312197 | 0.76 | AKT1 (0.43) | AKT1BRD4KMT2AMAPTCYP1A2 | |
| SCHEMBL3722973 | 0.74 | KMT2A (0.44) | AKT1KMT2AMAPTCYP1A2CYP2D6 | |
| SCHEMBL3605615 | 0.74 | KCNK3 (0.43) | AKT1KMT2AMAPTCYP1A2CYP2D6 | |
| SCHEMBL13142298 | 0.74 | KCNK3 (0.43) | AKT1KMT2AMAPTCYP1A2CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2146981-A1 | PHARMACEUTICAL COMPOUNDS | F. Hoffmann-Roche AG (CH) | 2010-01-27 | — | — | EP | disclosed |
| WO-2008125833-A1 | PHARMACEUTICAL COMPOUNDS | PIRAMED LIMITED (GB) | 2008-10-23 | — | — | WO | disclosed |
| WO-2008125833-A1 | PHARMACEUTICAL COMPOUNDS | PIRAMED LIMITED (GB) | 2008-10-23 | — | — | WO | disclosed |