Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | USP2 | O75604 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28017685 | 0.76 | ALDH1A1 (0.53) | ALDH1A1KDM4EUSP2KMT2AMAPT | |
| SCHEMBL182321 | 0.75 | ALDH1A1 (0.78) | ALDH1A1KDM4EUSP2KMT2AMAPT | |
| SCHEMBL6203162 | 0.74 | ALDH1A1 (0.55) | ALDH1A1KDM4EUSP2KMT2AMAPT | |
| Bromide SCHEMBL7249768 | 0.74 | ALDH1A1 (0.75) | ALDH1A1KDM4EUSP2KMT2AMAPT | |
| SCHEMBL12559833 | 0.72 | MAPT (0.52) | ALDH1A1KDM4EUSP2KMT2AMAPT | |
| SCHEMBL20344637 | 0.71 | TP53 (0.35) | ALDH1A1MAPTLMNA | |
| Maleic Acid SCHEMBL23501526 | 0.71 | ALDH1A1 (0.66) | ALDH1A1KDM4EUSP2KMT2AMAPT | |
| SCHEMBL11672345 | 0.71 | KMT2A (0.47) | ALDH1A1KDM4EUSP2KMT2AMAPT | |
| SCHEMBL11611598 | 0.71 | ALDH1A1 (0.59) | ALDH1A1KDM4EUSP2KMT2AMAPT | |
| SCHEMBL9796527 | 0.70 | RAB9A (0.50) | ALDH1A1KDM4EKMT2AMAPTMAPK1 |
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-3774739-B1 | FUSED CYCLIC UREA DERIVATIVES AS CRHR2 ANTAGONIST | RAQUALIA PHARMA INC (JP) | 2022-05-11 | — | — | EP | disclosed |