Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | PARP14 | Q460N5 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31390267 | 0.80 | ERAP1 (0.42) | KMT2APARP14MEN1MAPTRAB9A | |
| SCHEMBL28153768 | 0.78 | PARP14 (0.49) | KMT2APARP14MEN1MAPTRAB9A | |
| SCHEMBL5085480 | 0.77 | PPARG (0.71) | PPARGNPSR1MAPK1KMT2ATDP1 | |
| SCHEMBL5684603 | 0.76 | GRIN2D (0.59) | TDP1PARP14MAPTKDM4EALDH1A1 | |
| SCHEMBL30443913 | 0.76 | GRIN2D (0.59) | TDP1PARP14MAPTKDM4EALDH1A1 | |
| Hydrogen Peroxide SCHEMBL28221887 | 0.76 | KIF11 (0.55) | NPSR1MAPK1KMT2ATDP1PARP14 | |
| SCHEMBL27875227 | 0.75 | KMT2A (0.55) | NPSR1KMT2ASLC6A3PARP14MEN1 | |
| SCHEMBL17537989 | 0.75 | TDP1 (0.63) | PPARGNPSR1MAPK1KMT2ATDP1 | |
| SCHEMBL3105919 | 0.75 | ALDH1A1 (0.55) | MAPK1KMT2ATDP1SLC6A2SLC6A3 | |
| Acetic Acid SCHEMBL29087896 | 0.75 | PARP14 (0.50) | KMT2ATDP1PARP14MEN1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117756825-A | D-A aggregation-induced photovoltaic material based on boron fluoride complex and construction method thereof | 扬州工业职业技术学院 | 2024-03-26 | — | — | CN | claimed |
| CN-117756825-A | D-A aggregation-induced photovoltaic material based on boron fluoride complex and construction method thereof | 扬州工业职业技术学院 | 2024-03-26 | — | — | CN | disclosed |