Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 3/20 | 0.41 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.32 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10511880 | 0.90 | GRM5 (0.38) | GRM5AAK1SYKAURKBINCENP | |
| SCHEMBL9497092 | 0.87 | GRM5 (0.38) | GRM5SLC22A12 | |
| SCHEMBL9498411 | 0.84 | GRM5 (0.36) | GRM5MEN1GAAMAPTKMT2A | |
| SCHEMBL9496170 | 0.83 | GRM5 (0.35) | GRM5GAAMAPTRAB9A | |
| SCHEMBL9500393 | 0.82 | ACACB (0.35) | GRM5AAK1 | |
| SCHEMBL9497011 | 0.82 | ALDH1A1 (0.35) | GRM5GAAMAPT | |
| SCHEMBL9496861 | 0.80 | ACACB (0.38) | GRM5MEN1MAPTRAB9AKMT2A | |
| SCHEMBL9495259 | 0.78 | CASP3 (0.41) | MEN1MAPTRAB9AKMT2A | |
| SCHEMBL4147152 | 0.78 | GRM5 (0.55) | GRM5MEN1RAB9AKMT2A | |
| SCHEMBL9496334 | 0.77 | CASP3 (0.45) | MEN1GAAMAPTRAB9AKMT2A |
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-0306505-B1 | ACETYLENE DERIVATIVES AS COMPONENTS OF LIQUID CRYSTAL PHASES | MERCK PATENT GmbH (DE) | 1993-03-24 | — | — | EP | disclosed |
| US-5068053-A | Liquid crystals for optical apparatus | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-26 | — | — | US | disclosed |