Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA2 | P42262 | 7/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | XIAP | P98170 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 2/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11900094 | 0.89 | GRIA2 (0.52) | GRIA2CA1CA2PDE4APDE4B | |
| SCHEMBL7900252 | 0.85 | GRIA2 (0.50) | GRIA2CA1CA2PDE4APDE4B | |
| SCHEMBL7900317 | 0.82 | GRIA2 (0.49) | GRIA2CA1CA2PDE4APDE4B | |
| SCHEMBL7888226 | 0.81 | GRIA2 (0.49) | GRIA2CA1CA2PDE4APDE4B | |
| SCHEMBL1590737 | 0.81 | GRIA2 (0.54) | GRIA2CA1CA2PDE4APDE4B | |
| SCHEMBL1591092 | 0.81 | GRIA2 (0.62) | GRIA2CA1CA2PDE4APDE4B | |
| SCHEMBL7898009 | 0.81 | GRIA2 (0.48) | GRIA2CA1CA2ALDH1A1PDE4A | |
| SCHEMBL7890611 | 0.81 | GRIA2 (0.48) | GRIA2CA1CA2ALDH1A1HTT | |
| SCHEMBL7897516 | 0.80 | GRIA2 (0.56) | GRIA2MAOBHTR2AKCNH2 | |
| SCHEMBL7896164 | 0.80 | GRIA2 (0.49) | GRIA2ALDH1A1HTTKCNH2PARP1 |
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-2010115952-A1 | INDANE DERIVATIVES | N.V. ORGANON (NL) | 2010-10-14 | — | — | WO | disclosed |