Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.58 |
| ▸ | BRD4 | O60885 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 2/20 | 0.40 |
| ▸ | HNF4A | P41235 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL453514 | 0.85 | PARP1 (0.72) | PARP1ALDH1A1DHODHKDM4E | |
| Hydrochloric Acid SCHEMBL22165594 | 0.83 | PARP1 (0.70) | PARP1ALDH1A1DHODHKDM4E | |
| SCHEMBL9218238 | 0.83 | PARP1 (0.70) | PARP1ALDH1A1DHODHKDM4E | |
| SCHEMBL28284556 | 0.83 | PARP1 (0.70) | PARP1ALDH1A1DHODHKDM4E | |
| Hydrochloric Acid SCHEMBL2129546 | 0.83 | PARP1 (0.70) | PARP1ALDH1A1DHODHKDM4E | |
| Acetic Acid SCHEMBL7575146 | 0.81 | PARP1 (0.66) | PARP1DHODHKDM4E | |
| SCHEMBL20878376 | 0.77 | BRD4 (0.56) | PARP1BRD4ALDH1A1LMNAMAPT | |
| Trifluoroacetic Acid SCHEMBL20482044 | 0.77 | PARP1 (0.60) | PARP1DHODHKDM4E | |
| SCHEMBL28267894 | 0.75 | PARP1 (0.61) | PARP1KDM4E | |
| Tromethamine SCHEMBL16115019 | 0.74 | PARP1 (0.60) | PARP1KDM4E |
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-5081256-A | Para ordered aromatic diacids containing benzimidazole groups | UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1992-01-14 | — | — | US | disclosed |