Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 10/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 12/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 12/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | STAT1 | P42224 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7837159 | 0.79 | CYP1A2 (0.66) | CYP1A2CYP2C19MAPK1SMN1; SMN2POLB | |
| SCHEMBL7010519 | 0.78 | MAPK1 (0.48) | CYP1A2CYP2C19MAPK1SMN1; SMN2POLB | |
| SCHEMBL14814324 | 0.76 | CYP1A2 (0.47) | CYP1A2CYP2C19MAPK1SMN1; SMN2POLB | |
| SCHEMBL3487668 | 0.76 | MAPK1 (0.56) | CYP1A2CYP2C19MAPK1SMN1; SMN2POLB | |
| SCHEMBL11472621 | 0.74 | RAB9A (0.62) | CYP1A2CYP2C19MAPK1SMN1; SMN2RAB9A | |
| SCHEMBL1012539 | 0.72 | PTGS1 (0.46) | CYP1A2CYP2C19MAPK1SMN1; SMN2POLB | |
| SCHEMBL3180813 | 0.72 | CYP1A2 (0.43) | CYP1A2CYP2C19MAPK1SMN1; SMN2POLB | |
| SCHEMBL19086924 | 0.72 | SMN1; SMN2 (0.48) | CYP1A2CYP2C19MAPK1SMN1; SMN2POLB | |
| SCHEMBL18007651 | 0.69 | ALDH1A1 (0.49) | CYP1A2CYP2C19MAPK1SMN1; SMN2POLB | |
| SCHEMBL14828018 | 0.68 | RAB9A (0.59) | CYP1A2CYP2C19MAPK1SMN1; SMN2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0014263-B1 | METHOD OF IMPROVING THE SOLUBILITY OF BIOLOGICALLY ACTIVE AGENTS IN WATER AND IN LOWER ALIPHATIC ALCOHOLS, AND COMPOUNDS HAVING AN IMPROVED SOLUBILITY | BAYER AG (DE) | 1982-05-05 | — | — | EP | disclosed |