Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.54 |
| ▸ | CA1 | P00915 | 3/20 | 0.54 |
| ▸ | CA9 | Q16790 | 3/20 | 0.54 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6859827 | 0.91 | CA2 (0.63) | CA2CA1CA9CYP2C9CA12 | |
| SCHEMBL8052920 | 0.91 | CA2 (0.63) | CA2CA1CA9CYP2C9CA12 | |
| SCHEMBL5870520 | 0.85 | CA2 (0.56) | CA2CA1CA9KDM4EPOLB | |
| SCHEMBL7890851 | 0.85 | CA2 (0.56) | CA2CA1CA9KDM4EPOLB | |
| SCHEMBL11440251 | 0.84 | EGFR (0.53) | CA2CA1CA9EGFRERBB2 | |
| SCHEMBL828951 | 0.84 | EGFR (0.47) | CA2CA1CA9EGFRERBB2 | |
| SCHEMBL5697490 | 0.83 | GAA (0.55) | CA2CA1CA9EGFRERBB2 | |
| SCHEMBL776679 | 0.83 | CA1 (0.54) | CA2CA1CA9EGFRERBB2 | |
| SCHEMBL19067740 | 0.83 | CA2 (0.54) | CA2CA1CA9CYP2C9CYP1A2 | |
| SCHEMBL14266859 | 0.83 | CA2 (0.54) | CA2CA1CA9CYP2C9ALDH1A1 |
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-6225352-B1 | USEFUL AS AGENTS IN THE TREATMENT OF CANCER, ALZHEIMERS DISEASE, THROMBOSIS, INFLAMMATORY DISEASES, AND BACTERIAL RESISTANCE | WARNER-LAMBERT COMPANY | 2001-05-01 | — | — | US | disclosed |