Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 8/20 | 0.45 |
| ▸ | CA1 | P00915 | 7/20 | 0.45 |
| ▸ | CA2 | P00918 | 7/20 | 0.45 |
| ▸ | CA12 | O43570 | 6/20 | 0.45 |
| ▸ | AGTR1 | P30556 | 9/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | STAT6 | P42226 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL367747 | 0.86 | AGTR1 (0.48) | AGTR1EGFRAKR1C3AKR1C1 | |
| SCHEMBL365427 | 0.84 | ALDH1A1 (0.48) | CA9CA1CA2CA12CA5A | |
| SCHEMBL366462 | 0.82 | LMNA (0.46) | AGTR1EGFR | |
| SCHEMBL365147 | 0.81 | AGTR1 (0.39) | AGTR1EGFRAKR1C3AKR1C1 | |
| SCHEMBL366104 | 0.81 | CA9 (0.46) | CA9CA1CA2CA12CYP1A2 | |
| SCHEMBL365647 | 0.78 | IDO1 (0.43) | CA9CA1CA2CA12AGTR1 | |
| SCHEMBL366133 | 0.77 | AGTR1 (0.41) | AGTR1 | |
| SCHEMBL366888 | 0.77 | EGFR (0.44) | AGTR1EGFRCYP1A2CYP2C19 | |
| SCHEMBL365935 | 0.77 | KDM4E (0.47) | AGTR1EGFRCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL367707 | 0.77 | EGFR (0.44) | AGTR1EGFR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | claimed |
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |