Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7685587 | 1.00 | PARP1 (0.47) | PARP1MAPTTP53HPGDALDH1A1 | |
| SCHEMBL31749890 | 0.89 | PARP1 (0.50) | PARP1MAPTTP53HPGDALDH1A1 | |
| SCHEMBL7682832 | 0.89 | PARP1 (0.50) | PARP1MAPTTP53HPGDALDH1A1 | |
| SCHEMBL7682829 | 0.89 | PARP1 (0.50) | PARP1MAPTTP53HPGDALDH1A1 | |
| SCHEMBL1144588 | 0.83 | LMNA (0.57) | MAPTHPGDALDH1A1LMNAMEN1 | |
| SCHEMBL1144585 | 0.83 | LMNA (0.57) | MAPTHPGDALDH1A1LMNAMEN1 | |
| SCHEMBL6057368 | 0.78 | LMNA (0.64) | PARP1MAPTTP53HPGDALDH1A1 | |
| SCHEMBL4328293 | 0.75 | PARP1 (0.61) | PARP1MAPTHPGDALDH1A1MEN1 | |
| SCHEMBL4326883 | 0.75 | PARP1 (0.61) | PARP1MAPTHPGDALDH1A1MEN1 | |
| SCHEMBL4328296 | 0.75 | PARP1 (0.61) | PARP1MAPTHPGDALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6376521-B1 | ANTIINFLAMMATORY AGENTS; ANTIISCHEMIC AGENTS; CENTRAL NERVOUS SYSTEM DISORDERS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES | 2002-04-23 | — | — | US | disclosed |