Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | FBP1 | P09467 | 1/20 | 0.32 |
| ▸ | VHL | P40337 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7360320 | 0.83 | FBP1 (0.32) | FBP1 | |
| SCHEMBL7357363 | 0.78 | ALDH1A1 (0.40) | ALDH1A1KDM4EKMT2AMEN1LMNA | |
| SCHEMBL28244029 | 0.75 | ALDH1A1 (0.50) | ALDH1A1KDM4EKMT2AMEN1LMNA | |
| SCHEMBL12919878 | 0.75 | ALDH1A1 (0.53) | ALDH1A1KDM4EKMT2AMEN1LMNA | |
| SCHEMBL7355618 | 0.73 | FLT1 (0.30) | — | |
| SCHEMBL6298210 | 0.72 | ALDH1A1 (0.51) | ALDH1A1KDM4EKMT2AMEN1LMNA | |
| SCHEMBL8931349 | 0.72 | ALDH1A1 (0.55) | ALDH1A1KDM4EKMT2AMEN1LMNA | |
| Bicarbonate SCHEMBL27829730 | 0.72 | KDM4E (0.52) | ALDH1A1KDM4EKMT2AMEN1LMNA | |
| SCHEMBL10667247 | 0.72 | ALDH1A1 (0.50) | ALDH1A1KDM4EKMT2AMEN1LMNA | |
| SCHEMBL4236238 | 0.71 | KDM4E (0.43) | ALDH1A1KDM4EKMT2AMEN1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1112269-A2 | HIV PROTEASE INHIBITORS | WARNER-LAMBERT COMPANY (US) | 2001-07-04 | — | — | EP | disclosed |
| WO-2000015634-A2 | HIV PROTEASE INHIBITORS | WARNER-LAMBERT COMPANY (US) | 2000-03-23 | — | — | WO | disclosed |