Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NEU3 | Q9UQ49 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | KLK1 | P06870 | 1/20 | 0.33 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL24022830 | 0.87 | MKNK1 (0.38) | NEU3KLK1KLK5MAPTHPGD | |
| SCHEMBL24022755 | 0.86 | NEU3 (0.46) | NEU3HDAC6HDAC8HDAC2PLAU | |
| SCHEMBL24022749 | 0.80 | PRSS1 (0.48) | MAPTHPGDSMN1; SMN2HTTKMT2A | |
| SCHEMBL24022841 | 0.78 | NEU3 (0.46) | NEU3HDAC6KLK1KLK5MAPT | |
| SCHEMBL24022753 | 0.77 | HDAC8 (0.36) | NEU3HDAC6HDAC8HDAC2PLAU | |
| SCHEMBL12245538 | 0.74 | NEU3 (0.48) | NEU3HDAC6HDAC8HDAC2PLAU | |
| SCHEMBL22043785 | 0.74 | KDM4E (0.42) | NEU3HDAC6MAPTHPGDSMN1; SMN2 | |
| SCHEMBL22043759 | 0.74 | DGAT1 (0.46) | NEU3HDAC6KLK1KLK5HDAC1 | |
| SCHEMBL22044394 | 0.74 | RECQL (0.45) | MAPTTSHRNPC1RAB9A | |
| SCHEMBL31251149 | 0.73 | NEU3 (0.59) | NEU3HDAC6HDAC8HDAC2SMN1; SMN2 |
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-2021228992-A1 | NUCLIDE LABELLED H-TETRAZINES AND USE THEREOF FOR PET AND SPECT PRETARGETED IMAGING AND RADIONUCLIDE THERAPY | RIGSHOSPITALET (DK) | 2021-11-18 | — | — | WO | disclosed |