Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2198648 | 0.79 | POLB (0.32) | POLBGAAMAPT | |
| SCHEMBL2198644 | 0.79 | POLB (0.32) | POLBGAAMAPT | |
| SCHEMBL17541189 | 0.77 | POLB (0.41) | POLBGAAMAPTRAB9AHTT | |
| SCHEMBL18562654 | 0.77 | POLB (0.34) | POLBGAAMAPTRAB9AHTT | |
| SCHEMBL1463750 | 0.77 | POLB (0.41) | POLBGAAMAPTRAB9AHTT | |
| SCHEMBL17078043 | 0.76 | POLB (0.38) | POLBGAAHTT | |
| SCHEMBL16439492 | 0.76 | POLB (0.38) | POLBGAAHTT | |
| SCHEMBL17078032 | 0.69 | POLB (0.33) | POLB | |
| SCHEMBL24541238 | 0.67 | — | — | |
| SCHEMBL16790651 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3116862-B1 | PIPERAZINE DERIVATIVES AS HIV PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2019-04-17 | — | — | EP | disclosed |