Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 1/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 8/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 7/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.43 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7731608 | 0.85 | HDAC2 (0.40) | HDAC2HDAC1HDAC3 | |
| SCHEMBL27810920 | 0.80 | BCHE (0.61) | F2PRSS1BCHEHDAC2HDAC1 | |
| Trifluoroacetic Acid SCHEMBL7734262 | 0.78 | NMT1 (0.48) | F2PRSS1BCHEHDAC2HDAC1 | |
| SCHEMBL27652150 | 0.78 | HDAC3 (0.60) | F2PRSS1BCHEHDAC2HDAC1 | |
| SCHEMBL27742584 | 0.78 | F2 (0.63) | F2PRSS1BCHEHDAC2HDAC1 | |
| SCHEMBL4920022 | 0.77 | ALDH1A1 (0.52) | — | |
| SCHEMBL27630590 | 0.76 | HDAC3 (0.62) | F2PRSS1BCHEHDAC2HDAC1 | |
| SCHEMBL27709635 | 0.75 | BCHE (0.59) | F2PRSS1BCHEHDAC2HDAC1 | |
| SCHEMBL27962920 | 0.75 | CHRM3 (0.56) | F2PRSS1BCHE | |
| SCHEMBL7732604 | 0.75 | CCR5 (0.51) | — |
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-6399619-B1 | PREVENTION AND TREATMENT OF AIDS AND VIRAL INFECTION BY HIV | MERCK & CO., INC. | 2002-06-04 | — | — | US | disclosed |