Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.34 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.34 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14833338 | 0.76 | CYP19A1 (0.47) | CYP19A1CES2CES1AKR1B1 | |
| SCHEMBL31476894 | 0.69 | CES1 (0.50) | CES2CES1AKR1B1HIF1AEPHX2 | |
| SCHEMBL2866676 | 0.69 | CES1 (0.50) | CES2CES1AKR1B1HIF1AEPHX2 | |
| SCHEMBL21816275 | 0.68 | F2 (0.46) | CYP19A1 | |
| SCHEMBL24937837 | 0.68 | NPC1 (0.49) | — | |
| SCHEMBL553681 | 0.66 | CES1 (0.47) | CES2CES1AKR1B1HIF1A | |
| SCHEMBL553684 | 0.66 | CES1 (0.47) | CES2CES1AKR1B1HIF1A | |
| SCHEMBL3171335 | 0.65 | CES1 (0.54) | CES2CES1AKR1B1HIF1AEPHX2 | |
| SCHEMBL8508057 | 0.65 | P2RX4 (0.51) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL876240 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3946433-A1 | COMPOSITIONS, DEVICES AND METHODS FOR TREATING FABRY DISEASE | Sigilon Therapeutics, Inc. (US) | 2022-02-09 | — | — | EP | disclosed |