Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16142399 | 0.85 | ALDH1A1 (0.50) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL2295846 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL29439840 | 0.81 | ALDH1A1 (0.49) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL28693655 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL3674674 | 0.81 | ALDH1A1 (0.49) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL2295780 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL28152334 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL23969638 | 0.80 | ALDH1A1 (0.47) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL30496155 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL30731584 | 0.80 | ALDH1A1 (0.47) | ALDH1A1CYP1A2CYP2C9GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6160128-A | Tritioacetylating reagents and processes for preparation thereof | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2000-12-12 | — | — | US | claimed |
| US-6160128-A | Tritioacetylating reagents and processes for preparation thereof | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2000-12-12 | — | — | US | disclosed |