Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.37 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 5/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL5036313 | 0.87 | ALDH1A1 (0.38) | ALDH1A1PLA2G2CHPGDKMT2AGAA | |
| SCHEMBL28377502 | 0.87 | ALDH1A1 (0.38) | ALDH1A1PLA2G2CKDM4EHPGDKMT2A | |
| SCHEMBL8667807 | 0.83 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDKMT2AGAA | |
| SCHEMBL23611469 | 0.82 | ALDH1A1 (0.40) | ALDH1A1PLA2G2CKDM4EHPGDKMT2A | |
| SCHEMBL2217561 | 0.82 | ALDH1A1 (0.40) | ALDH1A1PLA2G2CKDM4EHPGDKMT2A | |
| SCHEMBL21458960 | 0.80 | CA12 (0.40) | ALDH1A1PLA2G2CKDM4EHPGDKMT2A | |
| SCHEMBL26613614 | 0.79 | STAT3 (0.38) | ALDH1A1KDM4EHPGDKMT2AGAA | |
| SCHEMBL8378760 | 0.78 | ALDH1A1 (0.40) | ALDH1A1KMT2AGAALMNAMEN1 | |
| SCHEMBL8796338 | 0.77 | CA12 (0.38) | ALDH1A1PLA2G2CKDM4EHPGDKMT2A | |
| SCHEMBL10397640 | 0.76 | GAA (0.43) | ALDH1A1KMT2AGAADHODHMEN1 |
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-3731869-A1 | IRAK DEGRADERS AND USES THEREOF | Kymera Therapeutics, Inc. (US) | 2020-11-04 | — | — | EP | disclosed |