Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6227452 | 0.99 | GPR35 (0.39) | GPR35ALDH1A1KDM4EHTTGAA | |
| SCHEMBL19090989 | 0.90 | ALDH1A1 (0.40) | GPR35ALDH1A1KDM4EHTTGAA | |
| SCHEMBL19958914 | 0.90 | ALDH1A1 (0.40) | GPR35ALDH1A1KDM4EHTTGAA | |
| SCHEMBL5872719 | 0.90 | ALDH1A1 (0.40) | ALDH1A1KDM4EHTTGAAL3MBTL1 | |
| SCHEMBL19090794 | 0.90 | ALDH1A1 (0.40) | ALDH1A1KDM4EHTTGAAL3MBTL1 | |
| Hydrochloric Acid SCHEMBL6371861 | 0.88 | ALDH1A1 (0.40) | ALDH1A1KDM4EHTTGAAL3MBTL1 | |
| Hydrochloric Acid SCHEMBL6224049 | 0.88 | ALDH1A1 (0.40) | GPR35ALDH1A1KDM4EHTTGAA | |
| Hydrochloric Acid SCHEMBL6778152 | 0.88 | ALDH1A1 (0.40) | ALDH1A1KDM4EHTTGAAL3MBTL1 | |
| SCHEMBL31089191 | 0.86 | ALDH1A1 (0.38) | GPR35ALDH1A1KDM4EHTTGAA | |
| SCHEMBL25752918 | 0.86 | L3MBTL1 (0.37) | GPR35ALDH1A1GAAL3MBTL1MEN1 |
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-2024175907-A1 | MACROCYCLIC ALPHA4BETA7 INTEGRIN INHIBITORS | C4X DISCOVERY LIMITED (GB) | 2024-08-29 | — | — | WO | disclosed |