Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL5592964 | 0.89 | CTSD (0.42) | CTSDCA1CA2CA9GABRA1 | |
| SCHEMBL1002816 | 0.81 | HTT (0.50) | GABRA1GABRB2ALDH1A1MEN1KMT2A | |
| SCHEMBL8087714 | 0.81 | GABRA1 (0.48) | GABRA1GABRB2ALDH1A1MEN1KMT2A | |
| SCHEMBL13670100 | 0.81 | KMT2A (0.50) | GABRA1GABRB2ALDH1A1MEN1KMT2A | |
| SCHEMBL3135538 | 0.81 | CTSD (0.56) | CTSDCA1CA2CA9ALDH1A1 | |
| SCHEMBL2257068 | 0.81 | GABRA1 (0.52) | GABRA1GABRB2ALDH1A1MEN1KMT2A | |
| SCHEMBL725761 | 0.79 | GABRA1 (0.50) | CA1CA2CA9GABRA1GABRB2 | |
| SCHEMBL157592 | 0.79 | FOLH1 (0.53) | CA1CA2CA9GABRA1GABRB2 | |
| SCHEMBL1788512 | 0.79 | ALDH1A1 (0.58) | CA1CA2CA9GABRA1GABRB2 | |
| SCHEMBL7447373 | 0.78 | GABRA1 (0.48) | GABRA1GABRB2ALDH1A1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007025775-A2 | CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2007-03-08 | — | — | WO | claimed |
| WO-2007025775-A2 | CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2007-03-08 | — | — | WO | disclosed |
| CN-1039016-A | N '-replacement-N, N '-two replaces the hydrazine insect repellent | ROHM & HAAS (US) | 1990-01-24 | — | — | CN | disclosed |