Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.44 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 14/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR1E | P28566 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27040297 | 1.00 | PARP1 (0.44) | PARP1PARP2GABRA5KDRPTGDR2 | |
| SCHEMBL30552565 | 0.85 | PARP1 (0.45) | PARP1PARP2GABRA5KDRPTGDR2 | |
| SCHEMBL29619433 | 0.85 | PARP1 (0.45) | PARP1PARP2GABRA5KDRPTGDR2 | |
| SCHEMBL29072082 | 0.85 | SMARCA2 (0.39) | — | |
| SCHEMBL24461314 | 0.75 | BAZ2B (0.55) | KDR | |
| SCHEMBL30552396 | 0.75 | BAZ2B (0.41) | MEN1KMT2A | |
| SCHEMBL27053267 | 0.74 | SMARCA2 (0.52) | PARP1PARP2 | |
| SCHEMBL27064491 | 0.73 | SMARCA2 (0.38) | MEN1KMT2AHTR1AADRA2A | |
| SCHEMBL23607097 | 0.71 | PBRM1 (0.40) | — | |
| SCHEMBL23607105 | 0.71 | PBRM1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116744929-A | Compounds and uses thereof | 福霍恩治疗公司 | 2023-09-12 | — | — | CN | disclosed |