Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TOP2A | P11388 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3977756 | 0.92 | REN (0.41) | ALDH1A1HTTSMN1; SMN2TACR1MAPT | |
| SCHEMBL3968591 | 0.92 | GAA (0.38) | ALDH1A1GAATACR1LMNATP53 | |
| SCHEMBL3977946 | 0.91 | MAPT (0.40) | ALDH1A1HTTSMN1; SMN2TACR1MAPT | |
| SCHEMBL3972591 | 0.85 | REN (0.43) | GAASMN1; SMN2TACR1LMNAKDM4E | |
| SCHEMBL3974580 | 0.84 | REN (0.41) | ALDH1A1TACR1SLC6A2SLC6A4HTR2A | |
| SCHEMBL3972940 | 0.84 | ALOX15 (0.40) | GAAMAPTSLC6A2SLC6A4HTR2A | |
| SCHEMBL3970195 | 0.84 | SLC6A2 (0.37) | ALDH1A1HTTGAASMN1; SMN2TACR1 | |
| SCHEMBL3972620 | 0.82 | TACR1 (0.38) | TACR1SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL3973372 | 0.80 | RXRA (0.41) | ALDH1A1GAAMAPTSLC6A2SLC6A4 | |
| SCHEMBL3971706 | 0.80 | SLC6A2 (0.35) | TACR1SLC6A2SLC6A4SLC6A3KCNH2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2054385-A2 | PHENYL, PYRIDINE AND QUINOLINE DERIVATIVES | F. Hoffmann-Roche AG (CH) | 2009-05-06 | — | — | EP | claimed |
| WO-2008019967-A2 | PHENYL, PYRIDINE AND QUINOLINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2008-02-21 | — | — | WO | claimed |
| EP-2054385-A2 | PHENYL, PYRIDINE AND QUINOLINE DERIVATIVES | F. Hoffmann-Roche AG (CH) | 2009-05-06 | — | — | EP | disclosed |
| WO-2008019967-A2 | PHENYL, PYRIDINE AND QUINOLINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2008-02-21 | — | — | WO | disclosed |