Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 4/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.44 |
| ▸ | TPMT | P51580 | 3/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1029279 | 0.84 | PDE4A (0.59) | HTTRAB9ALMNAMAPK1PDE4A | |
| SCHEMBL31325690 | 0.83 | KMT2A (0.53) | HTTRAB9ALMNAMAPK1TPMT | |
| SCHEMBL3951337 | 0.83 | KMT2A (0.53) | HTTRAB9ALMNAMAPK1TPMT | |
| SCHEMBL3413242 | 0.82 | MGLL (0.49) | HTTLMNACA12CA1CA2 | |
| SCHEMBL20042919 | 0.81 | HTT (0.64) | HTTRAB9ALMNAMAPK1PDE4A | |
| SCHEMBL2912588 | 0.81 | TTR (0.56) | HTTRAB9ALMNAMAPK1PDE4A | |
| SCHEMBL30147631 | 0.81 | HTT (0.64) | HTTRAB9ALMNAMAPK1PDE4A | |
| SCHEMBL16097840 | 0.79 | HTT (0.46) | HTTRAB9ALMNAMAPK1PDE4A | |
| SCHEMBL1014876 | 0.79 | TSHR (0.53) | HTTRAB9ALMNAMAPK1PDE4A | |
| SCHEMBL17020098 | 0.79 | HTT (0.49) | HTTRAB9ALMNAMAPK1PDE4A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010124047-A1 | BISARYL ALKYNYLAMIDES AS NEGATIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 5 (MGLUR5) | WYETH LLC (US) | 2010-10-28 | — | — | WO | disclosed |