Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.34 |
| ▸ | GRM7 | Q14831 | 3/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | XIAP | P98170 | 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 | |
|---|---|---|---|---|
| SCHEMBL20807130 | 0.81 | PARP1 (0.40) | PARP1 | |
| SCHEMBL22474799 | 0.78 | ALDH1A1 (0.35) | PARP1MTNR1AMTNR1B | |
| SCHEMBL18957322 | 0.76 | PARP1 (0.34) | PARP1GRM7MTNR1AMTNR1BXIAP | |
| SCHEMBL22474786 | 0.74 | HPGD (0.40) | — | |
| SCHEMBL23837552 | 0.74 | MTNR1A (0.36) | MTNR1AMTNR1B | |
| SCHEMBL23644550 | 0.72 | PARP1 (0.42) | PARP1 | |
| SCHEMBL23130227 | 0.70 | KMT2A (0.44) | — | |
| SCHEMBL23837606 | 0.69 | ALDH1A1 (0.43) | — | |
| SCHEMBL23130111 | 0.68 | ALDH1A1 (0.41) | MTNR1AMTNR1B | |
| SCHEMBL23837500 | 0.67 | MTNR1A (0.31) | PARP1MTNR1AMTNR1B |
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-2017100537-A1 | BETA-LACTAMASE INHIBITORS | VenatoRx Pharmaceuticals, Inc. (US) | 2017-06-15 | — | — | WO | disclosed |