Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 2/20 | 0.38 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KCNJ6 | P48051 | 2/20 | 0.35 |
| ▸ | KCNJ5 | P48544 | 2/20 | 0.35 |
| ▸ | KCNJ3 | P48549 | 2/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.34 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.34 |
| ▸ | TSPO | P30536 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6883811 | 0.93 | RNASEH1 (0.41) | PIN1RNASEH1ALDH1A1LMNAMAPT | |
| SCHEMBL6878297 | 0.92 | PIN1 (0.38) | PIN1RNASEH1 | |
| SCHEMBL6883865 | 0.86 | PIN1 (0.40) | PIN1RNASEH1TSPO | |
| SCHEMBL6884448 | 0.85 | PIN1 (0.41) | PIN1ALDH1A1LMNAMAPT | |
| SCHEMBL6883984 | 0.84 | HTR7 (0.41) | PIN1RNASEH1HSP90AA1SLC9A1 | |
| SCHEMBL6877025 | 0.84 | PIN1 (0.53) | PIN1RNASEH1 | |
| SCHEMBL6878396 | 0.81 | PTGES (0.41) | PIN1LMNA | |
| SCHEMBL6883326 | 0.81 | ALDH1A1 (0.44) | PIN1RNASEH1ALDH1A1LMNAMAPT | |
| SCHEMBL6883616 | 0.80 | PIN1 (0.40) | PIN1RNASEH1ALDH1A1HSP90AA1 | |
| SCHEMBL6882673 | 0.79 | ERCC1 (0.42) | PIN1RNASEH1ALDH1A1 |
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-2004096128-A2 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-11-11 | — | — | WO | claimed |
| WO-2004096128-A2 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-11-11 | — | — | WO | disclosed |