Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 3/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29490276 | 0.86 | NR1I2 (0.38) | ALDH1A1POLBNR1I2SLC29A1PTGES | |
| SCHEMBL29490229 | 0.86 | MAPT (0.35) | ALDH1A1POLBKDM4ENR1I2S1PR1 | |
| SCHEMBL24704321 | 0.85 | POLB (0.36) | ALDH1A1POLBKDM4ENR1I2S1PR1 | |
| SCHEMBL29490189 | 0.85 | POLB (0.36) | ALDH1A1POLBKDM4ENR1I2S1PR1 | |
| SCHEMBL29490259 | 0.80 | SLC29A1 (0.37) | ALDH1A1POLBKDM4ENR1I2SLC29A1 | |
| SCHEMBL29490287 | 0.75 | POLB (0.45) | ALDH1A1POLBMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL22862548 | 0.75 | POLB (0.45) | ALDH1A1POLBMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL29490307 | 0.75 | RAD52 (0.43) | ALDH1A1POLBNR1I2SLC29A1PTGES | |
| SCHEMBL22862469 | 0.74 | CYP11B1 (0.39) | ALDH1A1NR1I2SMN1; SMN2MAPK1 | |
| SCHEMBL22862960 | 0.74 | SLC29A1 (0.37) | ALDH1A1POLBKDM4ENR1I2SLC29A1 |
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-3976009-A2 | BAX INHIBITORS AND USES THEREOF | Case Western Reserve University (US) | 2022-04-06 | — | — | EP | disclosed |