Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 19/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 19/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 10/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 11/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8663042 | 0.80 | NR1I2 (0.46) | NR1I2CYP3A4CYP2D6HDAC1HDAC6 | |
| SCHEMBL8552757 | 0.78 | NR1I2 (0.50) | NR1I2CYP3A4CYP2D6HDAC1HDAC6 | |
| SCHEMBL8662288 | 0.77 | HDAC6 (0.48) | NR1I2CYP3A4CYP2D6HDAC1HDAC6 | |
| SCHEMBL8554371 | 0.77 | NR1I2 (0.49) | NR1I2CYP3A4CYP2D6HDAC1HDAC6 | |
| SCHEMBL8666620 | 0.76 | HDAC6 (0.49) | NR1I2CYP3A4CYP2D6HDAC1HDAC6 | |
| SCHEMBL8824452 | 0.72 | NR1I2 (0.64) | NR1I2CYP3A4CYP2D6HDAC1HDAC6 | |
| SCHEMBL8923477 | 0.72 | NR1I2 (0.64) | NR1I2CYP3A4CYP2D6HDAC1HDAC6 | |
| SCHEMBL8924056 | 0.71 | NR1I2 (0.60) | NR1I2CYP3A4CYP2D6HDAC1HDAC6 | |
| SCHEMBL8926521 | 0.71 | NR1I2 (0.69) | NR1I2CYP3A4CYP2D6HDAC1HDAC6 | |
| SCHEMBL9117253 | 0.71 | NR1I2 (0.59) | NR1I2CYP3A4CYP2D6HDAC1HDAC6 |
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-5763461-A | ANTIPICORNAVIRAL AGENTS | SANOFI (FR) | 1998-06-09 | — | — | US | disclosed |