Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | CTSD | P07339 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7138518 | 1.00 | HPGD (0.40) | HPGDTSHRALDH1A1KDM4ERCE1 | |
| SCHEMBL9177149 | 1.00 | HPGD (0.40) | HPGDTSHRALDH1A1KDM4ERCE1 | |
| SCHEMBL10656822 | 0.89 | TSHR (0.40) | HPGDTSHRALDH1A1KDM4ERCE1 | |
| SCHEMBL10656827 | 0.89 | TSHR (0.40) | HPGDTSHRALDH1A1KDM4ERCE1 | |
| SCHEMBL9265394 | 0.89 | HPGD (0.41) | HPGDTSHRALDH1A1KDM4ERCE1 | |
| SCHEMBL9022038 | 0.89 | HPGD (0.41) | HPGDTSHRALDH1A1KDM4ERCE1 | |
| SCHEMBL9944266 | 0.84 | HPGD (0.41) | HPGDTSHRALDH1A1KDM4ERCE1 | |
| SCHEMBL7658957 | 0.82 | HPGD (0.46) | HPGDALDH1A1KDM4ERCE1LMNA | |
| SCHEMBL7658965 | 0.82 | HPGD (0.46) | HPGDALDH1A1KDM4ERCE1LMNA | |
| SCHEMBL7658954 | 0.82 | HPGD (0.46) | HPGDALDH1A1KDM4ERCE1LMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0996439-B1 | BETA-ALKOXYACRYLATES AGAINST MALARIA | HOFFMANN LA ROCHE (CH) | 2003-01-08 | — | — | EP | disclosed |
| US-6084120-A | ACTIVE AGAINST CHLOROQUINE-SENSITIVE PATIENTS AND AGAINST CHLOROQUINE-RESISTANT MALARIA PATHOGENS; PROPHYLAXIS AND TREATMENT; E.G., A 3 METHOXY-2-(2-(4-PHENYLBUTA-1,3-DIEN-1-YL)PHENYL)ACRYLIC ACID | HOFFMANN-LA ROCHE INC. (US) | 2000-07-04 | — | — | US | disclosed |
| EP-0996439-A1 | $g(b)-ALKOXYACRYLATES AGAINST MALARIA | F. HOFFMANN-LA ROCHE AG (CH) | 2000-05-03 | — | — | EP | disclosed |
| WO-1999002150-A1 | β-ALKOXYACRYLATES AGAINST MALARIA | F. HOFFMANN-LA ROCHE AG (CH) | 1999-01-21 | — | — | WO | disclosed |