Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP26A1 | O43174 | 1/20 | 0.48 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | RGS12 | O14924 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28840697 | 0.93 | CYP26A1 (0.51) | CYP26A1CYP26B1AKR1B1ALDH1A1KMT2A | |
| SCHEMBL28922878 | 0.83 | PDCD1 (0.36) | CYP26A1CYP26B1AKR1B1ALDH1A1KMT2A | |
| SCHEMBL28953081 | 0.82 | CYP26A1 (0.46) | CYP26A1CYP26B1AKR1B1ALDH1A1KMT2A | |
| SCHEMBL6146899 | 0.81 | CYP26A1 (0.69) | CYP26A1CYP26B1AKR1B1 | |
| SCHEMBL30148869 | 0.80 | LMNA (0.33) | CYP26A1CYP26B1AKR1B1TSHRSMN1; SMN2 | |
| SCHEMBL1162271 | 0.77 | CYP26A1 (0.50) | CYP26A1CYP26B1AKR1B1ALDH1A1CA2 | |
| SCHEMBL6146444 | 0.77 | CYP26A1 (0.50) | CYP26A1CYP26B1AKR1B1ALDH1A1CA2 | |
| SCHEMBL28922901 | 0.77 | PIK3CA (0.33) | CYP26A1CYP26B1AKR1B1LMNA | |
| SCHEMBL31409465 | 0.73 | ALDH1A1 (0.57) | AKR1B1ALDH1A1KMT2ATSHRRAB9A | |
| SCHEMBL286952 | 0.73 | ALDH1A1 (0.60) | AKR1B1ALDH1A1KMT2ATSHRRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-115521325-A | Boronic acid derivatives | 首药控股(北京)股份有限公司 | 2022-12-27 | — | — | CN | disclosed |