Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C2 | P52895 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 7/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 2/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.38 |
| ▸ | BAD | Q92934 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7141751 | 1.00 | AKR1C2 (0.44) | AKR1C2NFE2L2AKR1C3MAOBRELA | |
| SCHEMBL7139096 | 0.88 | MAOB (0.42) | NFE2L2MAOBMEN1KMT2AAR | |
| SCHEMBL7139094 | 0.88 | MAOB (0.42) | NFE2L2MAOBMEN1KMT2AAR | |
| SCHEMBL7140080 | 0.87 | TUBB4A (0.40) | NFE2L2MAOBMEN1KMT2AAR | |
| SCHEMBL7140078 | 0.87 | TUBB4A (0.40) | NFE2L2MAOBMEN1KMT2AAR | |
| SCHEMBL7141550 | 0.86 | MAOB (0.43) | NFE2L2AKR1C3MAOBRELAMEN1 | |
| SCHEMBL7141545 | 0.86 | MAOB (0.43) | NFE2L2AKR1C3MAOBRELAMEN1 | |
| SCHEMBL7144375 | 0.85 | MAOB (0.44) | NFE2L2MAOBMEN1KMT2AMAPT | |
| SCHEMBL7144373 | 0.85 | MAOB (0.44) | NFE2L2MAOBMEN1KMT2AMAPT | |
| SCHEMBL7135431 | 0.85 | NFE2L2 (0.44) | NFE2L2MAOBRELAPTGS1PTGS2 |
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-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 |