Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | NPC1 | O15118 | 8/20 | 0.56 |
| ▸ | RAB9A | P51151 | 8/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.54 |
| ▸ | QPCT | Q16769 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | PDE5A | O76074 | 1/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.44 |
| ▸ | WNT3A | P56704 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 3/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.42 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Piperonylic Acid SCHEMBL8733060 | 0.90 | RAB9A (0.69) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8733059 | 0.87 | NPC1 (0.54) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5947 | 0.84 | KDM4E (0.53) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPT | |
| Hydrochloric Acid SCHEMBL9928726 | 0.83 | KDM4E (0.51) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPT | |
| Piperonylic Acid SCHEMBL31119409 | 0.80 | ALDH1A1 (1.00) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 | |
| Piperonylic Acid SCHEMBL3946119 | 0.80 | ALDH1A1 (1.00) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 | |
| Piperonylic Acid SCHEMBL142318 | 0.80 | ALDH1A1 (1.00) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 | |
| Piperonylic Acid SCHEMBL1184937 | 0.78 | ALDH1A1 (0.96) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL13373419 | 0.77 | QPCT (0.50) | ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28066117 | 0.73 | KDM4E (0.43) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0865439-A4 | COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS | ISIS PHARMACEUTICALS INC (US) | 1998-11-11 | — | — | EP | disclosed |
| EP-0865439-A1 | COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS | ISIS PHARMACEUTICALS, INC. (US) | 1998-09-23 | — | — | EP | disclosed |
| WO-1996040672-A1 | COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS | ISIS PHARMACEUTICALS, INC. (US) | 1996-12-19 | — | — | WO | disclosed |