Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.54 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5574505 | 0.85 | PARP1 (0.57) | PARP1PARP2MAPTKDM4ELMNA | |
| SCHEMBL5574511 | 0.85 | PARP1 (0.57) | PARP1PARP2MAPTKDM4ELMNA | |
| Acetic Acid SCHEMBL7748731 | 0.85 | PARP1 (0.58) | PARP1PARP2MAPTKDM4ELMNA | |
| Acetic Acid SCHEMBL7748734 | 0.85 | PARP1 (0.58) | PARP1PARP2MAPTKDM4ELMNA | |
| SCHEMBL7743153 | 0.83 | PARP1 (0.64) | PARP1PARP2MAPTKDM4ELMNA | |
| SCHEMBL7743155 | 0.83 | PARP1 (0.64) | PARP1PARP2MAPTKDM4ELMNA | |
| SCHEMBL916162 | 0.82 | KDM4E (0.61) | PARP1PARP2MAPTKDM4ELMNA | |
| SCHEMBL917029 | 0.82 | HPGD (0.58) | MAPTKDM4ELMNAHPGDSMN1; SMN2 | |
| SCHEMBL915015 | 0.79 | MAPT (0.55) | MAPTKDM4ELMNAHPGDSMN1; SMN2 | |
| SCHEMBL915133 | 0.78 | MAPT (0.49) | MAPTKDM4ELMNAHPGDSMN1; 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-2001025192-A1 | GUANIDINE DERIVATIVES AND THEIR USE IN THE PRODUCTION OF A MEDICAMENT FOR BLOCKING XANTHINE OXIDASE/DEHYDROGENASE | MELACURE THERAPEUTICS AB (SE) | 2001-04-12 | — | — | WO | disclosed |