Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | PLAT | P00750 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CMA1 | P23946 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9940798 | 0.84 | PARP1 (0.38) | PARP1MAPTKMT2AALDH1A1TSHR | |
| SCHEMBL9977655 | 0.81 | PARP1 (0.37) | PARP1ADORA1MAPTKMT2AALDH1A1 | |
| SCHEMBL26134476 | 0.81 | PARP1 (0.37) | PARP1MAPTKMT2AALDH1A1TSHR | |
| SCHEMBL26135724 | 0.81 | MAPT (0.37) | PARP1MAPTKMT2AALDH1A1TSHR | |
| SCHEMBL9938811 | 0.81 | KDM5B (0.39) | PARP1MAPTKMT2AALDH1A1APP | |
| SCHEMBL26134848 | 0.80 | PARP1 (0.36) | PARP1MAPTKMT2AALDH1A1TSHR | |
| SCHEMBL26134986 | 0.79 | ELANE (0.35) | PARP1PLATALDH1A1TSHRPOLB | |
| SCHEMBL21130895 | 0.76 | PDE4D (0.41) | PARP1MAPTPLATALDH1A1TSHR | |
| SCHEMBL26686728 | 0.75 | KDM5B (0.38) | PARP1MAPTKMT2AALDH1A1APP | |
| SCHEMBL16699032 | 0.74 | ADORA3 (0.37) | PARP1KMT2APLATALDH1A1TSHR |
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-117279917-A | Piperazine derivatives and their use in medicine | 成都百裕制药股份有限公司 | 2023-12-22 | — | — | CN | disclosed |