Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL9705614 | 0.90 | TDP1 (0.39) | TDP1ALDH1A1MAPTATMHPGD | |
| SCHEMBL7186704 | 0.90 | TDP1 (0.39) | TDP1ALDH1A1MAPTATMHPGD | |
| SCHEMBL7192028 | 0.80 | TDP1 (0.37) | TDP1ALDH1A1MAPTATMHPGD | |
| SCHEMBL9871979 | 0.77 | TDP1 (0.41) | TDP1ALDH1A1MAPTATMHPGD | |
| SCHEMBL9032262 | 0.75 | TDP1 (0.36) | TDP1ALDH1A1MAPTATMHPGD | |
| SCHEMBL11202124 | 0.74 | ALDH1A1 (0.38) | ALDH1A1MAPTHPGD | |
| SCHEMBL10735072 | 0.73 | HTR2A (0.37) | TDP1ALDH1A1MAPTATMHPGD | |
| SCHEMBL10734182 | 0.73 | HTR2A (0.37) | TDP1ALDH1A1MAPTATMHPGD | |
| SCHEMBL9670137 | 0.73 | ALDH1A1 (0.39) | TDP1ALDH1A1MAPTHPGD | |
| SCHEMBL10730067 | 0.72 | HTT (0.38) | ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0508234-B1 | Beta-lactames | HOFFMANN LA ROCHE (CH) | 1996-07-24 | — | — | EP | disclosed |
| EP-0508234-A2 | Beta-lactames | F. HOFFMANN-LA ROCHE AG (CH) | 1992-10-14 | — | — | EP | disclosed |