Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.56 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2551920 | 0.83 | ALDH1A1 (0.57) | ALDH1A1KDM4ERECQLKEAP1TDP1 | |
| SCHEMBL2551922 | 0.83 | ALDH1A1 (0.57) | ALDH1A1KDM4ERECQLKEAP1TDP1 | |
| SCHEMBL5593707 | 0.83 | ALDH1A1 (0.57) | ALDH1A1KDM4ERECQLKEAP1TDP1 | |
| Water SCHEMBL27851978 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KDM4ERECQLKEAP1TDP1 | |
| SCHEMBL2683097 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KDM4ERECQLKEAP1TDP1 | |
| SCHEMBL14667519 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KDM4ERECQLKEAP1TDP1 | |
| SCHEMBL21966469 | 0.79 | ALDH1A1 (0.53) | ALDH1A1KDM4ERECQLKEAP1TDP1 | |
| SCHEMBL13762098 | 0.79 | KDM4E (0.49) | ALDH1A1KDM4ERECQLKEAP1TDP1 | |
| SCHEMBL18755024 | 0.78 | ALDH1A1 (0.52) | ALDH1A1KDM4ERECQLKEAP1TDP1 | |
| SCHEMBL19433078 | 0.77 | KDM4E (0.49) | ALDH1A1KDM4EKMT2AHDAC8HDAC6 |
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-2023279031-A1 | METHODS AND COMPOSITIONS FOR TREATMENT OF COVID-19 | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2023-01-05 | — | — | WO | disclosed |