Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | S100A4 | P26447 | 1/20 | 0.33 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | BCL2 | P10415 | 1/20 | 0.30 |
| ▸ | METAP1 | P53582 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29540403 | 0.88 | PDK2 (0.48) | PDK2AKR1A1AKR1B1S100A4TDP2 | |
| SCHEMBL206283 | 0.88 | PDK2 (0.48) | PDK2AKR1A1AKR1B1S100A4TDP2 | |
| SCHEMBL14733213 | 0.88 | PDK2 (0.33) | PDK2 | |
| SCHEMBL13231061 | 0.84 | PDK2 (0.46) | PDK2AKR1A1AKR1B1S100A4TDP2 | |
| SCHEMBL13567287 | 0.84 | PDK2 (0.31) | PDK2 | |
| SCHEMBL9883321 | 0.81 | PDK2 (0.38) | PDK2AKR1A1AKR1B1S100A4TDP2 | |
| SCHEMBL17880891 | 0.78 | PDK2 (0.59) | PDK2AKR1A1AKR1B1S100A4 | |
| SCHEMBL19764175 | 0.78 | PDK2 (0.48) | PDK2AKR1A1AKR1B1S100A4TDP2 | |
| SCHEMBL13915807 | 0.78 | PDK2 (0.36) | PDK2AKR1A1AKR1B1S100A4TDP2 | |
| SCHEMBL13915805 | 0.78 | PDK2 (0.36) | PDK2AKR1A1AKR1B1S100A4TDP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012068234-A2 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2012-05-24 | — | — | WO | disclosed |
| WO-2010132601-A1 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2010-11-18 | — | — | WO | disclosed |