Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | IDO1 | P14902 | 2/20 | 0.54 |
| ▸ | P2RX7 | Q99572 | 13/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.48 |
| ▸ | PPARG | P37231 | 2/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 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 | |
|---|---|---|---|---|
| SCHEMBL13590954 | 0.81 | IDO1 (0.54) | HDAC3HDAC1HDAC2HDAC6IDO1 | |
| SCHEMBL3278241 | 0.80 | IDO1 (0.61) | HDAC3HDAC1HDAC2HDAC6IDO1 | |
| SCHEMBL5723612 | 0.78 | P2RX7 (0.57) | HDAC3HDAC1HDAC2HDAC6P2RX7 | |
| SCHEMBL1538597 | 0.78 | IDO1 (0.63) | HDAC3HDAC1HDAC2HDAC6IDO1 | |
| SCHEMBL6078520 | 0.77 | IDO1 (0.54) | HDAC3HDAC1HDAC2HDAC6IDO1 | |
| SCHEMBL22854936 | 0.77 | IDO1 (0.50) | HDAC3HDAC1HDAC2HDAC6IDO1 | |
| SCHEMBL16538163 | 0.76 | IDO1 (0.49) | HDAC3HDAC1HDAC2HDAC6IDO1 | |
| SCHEMBL4576232 | 0.76 | P2RX7 (0.55) | HDAC3HDAC1HDAC2HDAC6IDO1 | |
| SCHEMBL16538118 | 0.76 | P2RX7 (0.57) | HDAC3HDAC1HDAC2HDAC6IDO1 | |
| SCHEMBL22445529 | 0.76 | IDO1 (0.56) | HDAC3HDAC1HDAC2HDAC6IDO1 |
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-2015114031-A1 | PRIMARY HYDROXYLAMINES AND USES THEREOF | FUNDACIÓ INSTITUT DE BIOENGINYERIA DE CATALUNYA (IBEC) (ES) | 2015-08-06 | — | — | WO | disclosed |
| WO-2015114031-A1 | PRIMARY HYDROXYLAMINES AND USES THEREOF | FUNDACIÓ INSTITUT DE BIOENGINYERIA DE CATALUNYA (IBEC) (ES) | 2015-08-06 | — | — | WO | disclosed |