Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 5/20 | 0.41 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26815145 | 0.90 | AR (0.39) | ALDH1A1KDM4EHSD17B10HPGDMAPT | |
| SCHEMBL22016170 | 0.78 | KIF11 (0.42) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL1771213 | 0.76 | ALDH1A1 (0.36) | ALDH1A1KDM4EHSD17B10HPGDMAPT | |
| SCHEMBL22017134 | 0.75 | ATM (0.38) | ALDH1A1KDM4EHSD17B10HPGDSMN1; SMN2 | |
| SCHEMBL1772049 | 0.72 | KDM4E (0.64) | ALDH1A1KDM4EHSD17B10HPGDMAPT | |
| SCHEMBL26817285 | 0.72 | GRM2 (0.38) | USP2 | |
| SCHEMBL22016560 | 0.71 | AR (0.40) | ALDH1A1KDM4EHSD17B10HPGDMAPT | |
| SCHEMBL8000647 | 0.67 | ALDH1A1 (0.61) | ALDH1A1KDM4EHSD17B10HPGDMAPT | |
| SCHEMBL26817271 | 0.66 | HRH3 (0.40) | — | |
| SCHEMBL1773043 | 0.66 | KDM4E (0.48) | ALDH1A1KDM4EHSD17B10HPGDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023220741-A1 | ALPHA 4 BETA 7 INTEGRIN MODULATORS AND USES THEREOF | DICE MOLECULES SV, INC. (US) | 2023-11-16 | — | — | WO | disclosed |