Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.37 |
| ▸ | PARP10 | Q53GL7 | 4/20 | 0.35 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.35 |
| ▸ | CES2 | O00748 | 2/20 | 0.33 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.33 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.33 |
| ▸ | NEU3 | Q9UQ49 | 1/20 | 0.32 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KLK1 | P06870 | 1/20 | 0.32 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL22043753 | 0.90 | EPHX2 (0.39) | DGAT1HDAC1HDAC6CES2CES1 | |
| SCHEMBL24022755 | 0.86 | NEU3 (0.46) | DGAT1HDAC1HDAC6NEU3 | |
| SCHEMBL22043785 | 0.85 | KDM4E (0.42) | HDAC1HDAC6NEU3KMT2A | |
| SCHEMBL24022830 | 0.83 | MKNK1 (0.38) | NEU3KLK1KLK5 | |
| SCHEMBL24022848 | 0.78 | HDAC1 (0.50) | HDAC1HDAC6MEN1KMT2AKDM1A | |
| SCHEMBL24022836 | 0.76 | HDAC1 (0.62) | HDAC1HDAC6NEU3KLK1KLK5 | |
| SCHEMBL811354 | 0.76 | DGAT1 (0.62) | DGAT1HDAC1HDAC6PARP10PARP15 | |
| SCHEMBL24022845 | 0.75 | RAB9A (0.50) | MEN1KMT2AKDM1A | |
| SCHEMBL24039027 | 0.74 | NEU3 (0.48) | HDAC1HDAC6NEU3KMT2AKLK1 | |
| SCHEMBL22044273 | 0.73 | GRIN2B (0.44) | CES2CES1KMT2A |
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-2020108720-A1 | NOVEL TETRAZINE COMPOUNDS FOR IN VIVO IMAGING | Københavns Universitet (DK) | 2020-06-04 | — | — | WO | disclosed |