Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BPTF | Q12830 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL19402043 | 0.74 | RPS6KA5 (0.35) | — | |
| SCHEMBL13518620 | 0.72 | BPTF (0.41) | BPTFCYP1A2KMT2ACHRNB2CHRNA4 | |
| SCHEMBL2515107 | 0.72 | GRM5 (0.48) | BPTFCYP1A2KMT2ACHRNB2CHRNA4 | |
| SCHEMBL2560735 | 0.71 | GRM5 (0.40) | — | |
| SCHEMBL6224475 | 0.66 | MMP13 (0.40) | CYP1A2KDM4EGAAMAPTLMNA | |
| SCHEMBL2556629 | 0.66 | GRM5 (0.35) | — | |
| SCHEMBL10867132 | 0.65 | HSD11B1 (0.30) | — | |
| SCHEMBL8306096 | 0.65 | MAPT (0.42) | MAPTLMNAHTT | |
| SCHEMBL3780261 | 0.64 | PDE9A (0.38) | MAPT | |
| SCHEMBL3785201 | 0.64 | AR (0.55) | CHRNB2CHRNA4GAAMAPTHTT |
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-2558457-A1 | ARYLETHYNYL DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2013-02-20 | — | — | EP | disclosed |
| WO-2011128279-A1 | ARYLETHYNYL DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-10-20 | — | — | WO | disclosed |