Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7961734 | 0.73 | ADAMTS5 (0.40) | ADRA1DPOLBIDO1TDO2PARP1 | |
| SCHEMBL9769184 | 0.72 | — | — | |
| SCHEMBL23330960 | 0.72 | ALOX5 (0.39) | ADRA1DPOLBIDO1TDO2PARP1 | |
| SCHEMBL266174 | 0.72 | — | — | |
| SCHEMBL9077879 | 0.71 | TSHR (0.36) | ADRA1DPOLB | |
| SCHEMBL7960171 | 0.69 | NPSR1 (0.46) | POLB | |
| SCHEMBL10947172 | 0.69 | — | — | |
| SCHEMBL7380102 | 0.68 | — | — | |
| SCHEMBL13510846 | 0.68 | — | — | |
| SCHEMBL27658638 | 0.68 | ALDH1A1 (0.43) | ADRA1DPOLBIDO1TDO2PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007002172-A2 | HIV-1 PROTEASE INHIBITORS | UNIVERSITY OF MASSACHUSETTS (US) | 2007-01-04 | — | — | WO | disclosed |