Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | APAF1 | O14727 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4828917 | 0.89 | SRC (0.54) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL21961154 | 0.82 | CYP2D6 (0.46) | CYP2D6SRCLMNAMAPK1PTGS2 | |
| SCHEMBL21687919 | 0.77 | SRC (0.50) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL4740644 | 0.77 | SRC (0.50) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL21687922 | 0.77 | SRC (0.50) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL14506219 | 0.76 | SRC (0.54) | CYP2D6SRCLMNAMAPK1ALDH1A1 | |
| SCHEMBL2119361 | 0.73 | CYP2D6 (0.46) | CYP2D6SRCLMNAMAPK1PTGS2 | |
| SCHEMBL7303575 | 0.73 | CYP2D6 (0.46) | CYP2D6SRCLMNAMAPK1PTGS2 | |
| SCHEMBL28787282 | 0.72 | EPHX1 (0.53) | CYP2D6SRCLMNAMAPK1 | |
| SCHEMBL3060024 | 0.72 | SRC (0.50) | CYP2D6SRCLMNAMAPK1ALDH1A1 |
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-2798001-A1 | METHOD FOR PRODUCING PURIFIED NITRILE RUBBERS | LANXESS Deutschland GmbH (DE) | 2014-11-05 | — | — | EP | disclosed |
| WO-2013098073-A1 | METHOD FOR PRODUCING PURIFIED NITRILE RUBBERS | LANXESS DEUTSCHLAND GMBH (DE) | 2013-07-04 | — | — | WO | disclosed |