Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 3/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL7871611 | 0.84 | TDP1 (0.33) | TDP1DGAT1CTSK | |
| SCHEMBL78520 | 0.81 | DGAT1 (0.46) | TDP1DGAT1CTSK | |
| SCHEMBL679523 | 0.78 | — | — | |
| SCHEMBL4494018 | 0.77 | TDP1 (0.39) | TDP1DGAT1CTSKHDAC6HDAC3 | |
| Hydrazine SCHEMBL10794464 | 0.75 | DGAT1 (0.42) | TDP1DGAT1 | |
| SCHEMBL3115142 | 0.72 | TDP1 (0.33) | TDP1 | |
| SCHEMBL29399642 | 0.72 | — | — | |
| SCHEMBL2712242 | 0.70 | DGAT1 (0.39) | TDP1DGAT1 | |
| SCHEMBL10883850 | 0.70 | DGAT1 (0.39) | TDP1DGAT1 | |
| SCHEMBL4288100 | 0.70 | DGAT1 (0.50) | TDP1DGAT1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102816106-A | Biocatalytic processes for the preparation of substantially stereomerically pure fused bicyclic proline compounds | CODEXIS INC | 2012-12-12 | — | — | CN | disclosed |
| CN-102131813-A | Biocatalytic process for the preparation of substantially stereoisomerically pure fused bicyclic proline compounds | CODEXIS INC | 2011-07-20 | — | — | CN | disclosed |