Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | AKT1 | P31749 | 10/20 | 0.42 |
| ▸ | AKT2 | P31751 | 10/20 | 0.42 |
| ▸ | ADK | P55263 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13800291 | 0.83 | AKT1 (0.42) | ADORA1AKT1AKT2ADKADORA2A | |
| SCHEMBL13263614 | 0.79 | AKT1 (0.50) | ADORA1AKT1AKT2ADKADORA2A | |
| SCHEMBL11077623 | 0.76 | ADORA1 (0.53) | ADORA1ADORA2A | |
| SCHEMBL13263611 | 0.76 | ADORA1 (0.38) | ADORA1ADORA2A | |
| SCHEMBL26551670 | 0.72 | TDP1 (0.66) | TDP1AKT1KDM4EPOLBADORA2A | |
| SCHEMBL17993487 | 0.72 | ALDH1A1 (0.58) | ADORA1TDP1ADORA2AALDH1A1 | |
| SCHEMBL3707264 | 0.71 | AKT1 (0.58) | AKT1AKT2 | |
| SCHEMBL4400284 | 0.71 | KDM4E (0.49) | ADORA1TDP1KDM4EPOLBPPARG | |
| SCHEMBL362354 | 0.70 | PSMB5 (0.45) | ADORA1ADKADORA2A | |
| SCHEMBL8139793 | 0.69 | ADK (0.55) | TDP1AKT1AKT2ADKKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-7544677-B2 | Inhibitors of Akt activity | MERCK & CO., INC. (US) | 2009-06-09 | — | — | US | disclosed |