Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 13/20 | 0.48 |
| ▸ | NPC1 | O15118 | 12/20 | 0.48 |
| ▸ | PKM | P14618 | 4/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL24022832 | 0.82 | PRSS1 (0.43) | PARP1RAB9ANPC1GAA | |
| SCHEMBL22044441 | 0.80 | PARP1 (0.55) | PARP1RAB9ANPC1PKMHDAC8 | |
| SCHEMBL22044405 | 0.79 | PARP1 (0.50) | PARP1RAB9ANPC1PKMHDAC6 | |
| SCHEMBL22043777 | 0.79 | PARP1 (0.53) | PARP1RAB9ANPC1PKMHDAC8 | |
| SCHEMBL21589373 | 0.79 | PARP1 (0.53) | PARP1RAB9ANPC1PKMHDAC8 | |
| SCHEMBL22043779 | 0.78 | CYP2D6 (0.47) | RAB9ANPC1PKMHDAC6SMN1; SMN2 | |
| SCHEMBL18891357 | 0.77 | KMT2A (0.48) | PARP1RAB9ANPC1PKMSMN1; SMN2 | |
| SCHEMBL24022749 | 0.77 | PRSS1 (0.48) | RAB9ANPC1PKMSMN1; SMN2HPGD | |
| SCHEMBL103984 | 0.76 | PARP1 (0.59) | PARP1RAB9ANPC1PKMHDAC8 | |
| SCHEMBL6841043 | 0.76 | PARP1 (0.59) | PARP1RAB9ANPC1PKMHDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| WO-2020108720-A1 | NOVEL TETRAZINE COMPOUNDS FOR IN VIVO IMAGING | Københavns Universitet (DK) | 2020-06-04 | — | — | WO | disclosed |