Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NMT1 | P30419 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | BCHE | P06276 | 8/20 | 0.48 |
| ▸ | MC4R | P32245 | 1/20 | 0.45 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.44 |
| ▸ | F2 | P00734 | 2/20 | 0.44 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13739175 | 0.92 | BCHE (0.55) | NMT1CHRM3BCHEMC4RKCNA3 | |
| Trifluoroacetic Acid SCHEMBL7731606 | 0.87 | HTR2C (0.41) | NMT1CHRM3HDAC3HDAC1HDAC2 | |
| SCHEMBL13177134 | 0.84 | MC4R (0.52) | NMT1CHRM3BCHEMC4RKCNA3 | |
| SCHEMBL28023547 | 0.84 | MC4R (0.52) | NMT1CHRM3BCHEMC4RKCNA3 | |
| SCHEMBL27810920 | 0.82 | BCHE (0.61) | BCHEMC4RKCNA3F2PRSS1 | |
| SCHEMBL27557534 | 0.80 | MC4R (0.59) | BCHEMC4R | |
| SCHEMBL27742584 | 0.80 | F2 (0.63) | BCHEKCNA3F2PRSS1HDAC3 | |
| SCHEMBL27652150 | 0.80 | HDAC3 (0.60) | BCHEKCNA3F2PRSS1HDAC3 | |
| SCHEMBL27630590 | 0.78 | HDAC3 (0.62) | BCHEKCNA3F2PRSS1HDAC3 | |
| SCHEMBL7734264 | 0.78 | F2 (0.47) | BCHEKCNA3F2PRSS1HDAC3 |
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 |