Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GPR3 | P46089 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9867248 | 0.85 | MAT2A (0.39) | ALDH1A1HTR6KDM4ESCN9ASCN5A | |
| SCHEMBL11393569 | 0.83 | PSEN1 (0.37) | ALDH1A1RAB9APOLBMEN1KMT2A | |
| SCHEMBL11401796 | 0.81 | ALDH1A1 (0.52) | ALDH1A1HTR6KDM4EMAPK1HTT | |
| SCHEMBL9796294 | 0.81 | ALDH1A1 (0.40) | ALDH1A1CYP2C9HTR6CYP1A2KDM4E | |
| SCHEMBL7322441 | 0.80 | KIF11 (0.41) | SCN9ASCN5A | |
| SCHEMBL9868894 | 0.80 | ALDH1A1 (0.36) | ALDH1A1RAB9APOLBMEN1HPGD | |
| SCHEMBL9796302 | 0.76 | SCN9A (0.37) | ALDH1A1CYP2C9HTR6CYP1A2KDM4E | |
| Flosequinan SCHEMBL122877 | 0.76 | ATM (0.47) | ALDH1A1KDM4ESCN9AMEN1KMT2A | |
| Flosequinan SCHEMBL5442796 | 0.76 | ATM (0.47) | ALDH1A1KDM4ESCN9AMEN1KMT2A | |
| Flosequinan SCHEMBL5441172 | 0.76 | ATM (0.47) | ALDH1A1KDM4ESCN9AMEN1KMT2A |
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-1991002724-A1 | THERAPEUTIC AGENTS | THE BOOTS COMPANY PLC (GB) | 1991-03-07 | — | — | WO | disclosed |