Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 15/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL6795423 | 0.76 | PARP1 (0.61) | PARP1ALDH1A1GAA | |
| SCHEMBL11001148 | 0.71 | LMNA (0.41) | PARP1ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL28182064 | 0.71 | PARP1 (0.50) | PARP1ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL6835431 | 0.70 | PARP1 (0.49) | PARP1KDM4E | |
| SCHEMBL3976873 | 0.69 | HSD17B10 (0.50) | ALDH1A1GAAKDM4EHPGDHSD17B10 | |
| SCHEMBL31256820 | 0.68 | MCL1 (0.43) | PARP1GAAMAPT | |
| SCHEMBL7855110 | 0.68 | MCL1 (0.43) | PARP1GAAMAPT | |
| SCHEMBL31256887 | 0.67 | PRKCQ (0.42) | KDM4E | |
| SCHEMBL31256810 | 0.66 | MCL1 (0.33) | PARP1 | |
| SCHEMBL6200483 | 0.65 | PARP1 (1.00) | PARP1 |
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-4348521-A | BACTERICIDES, FUNGICIDES | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1982-09-07 | — | — | US | disclosed |