Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | PRKDC | P78527 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1904655 | 0.77 | QPCT (0.39) | ALDH1A1KDM4ETSHRTDP1ERN1 | |
| SCHEMBL13736042 | 0.75 | NUDT1 (0.39) | ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL8580981 | 0.75 | ALDH1A1 (0.49) | ALDH1A1KDM4ETSHRTDP1ERN1 | |
| SCHEMBL2896220 | 0.75 | CYP1A2 (0.39) | ALDH1A1KDM4E | |
| SCHEMBL10183728 | 0.74 | AURKA (0.34) | GAA | |
| SCHEMBL10233516 | 0.74 | DHFR (0.33) | — | |
| SCHEMBL10184975 | 0.73 | MAPT (0.35) | — | |
| SCHEMBL22148915 | 0.73 | SYK (0.33) | ALDH1A1GAA | |
| SCHEMBL10220295 | 0.73 | GAA (0.44) | GAA | |
| SCHEMBL10235623 | 0.72 | CCNA2 (0.32) | — |
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-110036009-A | Substituted pyrrolidines and their use in the treatment of cystic fibrosis | 艾伯维公司 | 2019-07-19 | — | — | CN | disclosed |