Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.43 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.43 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.40 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | USP30 | Q70CQ3 | 4/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21649123 | 1.00 | MAOA (0.44) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL8730882 | 0.98 | MAOA (0.47) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL8730878 | 0.98 | MAOA (0.47) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL21649125 | 0.96 | GRIA1 (0.43) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL8767080 | 0.95 | HRH3 (0.49) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL8767087 | 0.95 | HRH3 (0.49) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL13621591 | 0.94 | GRIA1 (0.46) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL250894 | 0.88 | MAOA (0.50) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL5958188 | 0.88 | GRIA1 (0.49) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL8767792 | 0.87 | ESR2 (0.44) | MAOAMAOBGRIA1GRIA2GRIA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0789067-A1 | Cyclopentyl derivatives useful as liquid crystals | Rolic AG (CH) | 1997-08-13 | — | — | EP | disclosed |