Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | GCGR | P47871 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | ACACB | O00763 | 2/20 | 0.34 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.34 |
| ▸ | RARA | P10276 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | RARG | P13631 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL9511355 | 0.95 | CYP2A6 (0.39) | LMNAGCGRMAPK14FFAR1CYP2A6 | |
| SCHEMBL9509130 | 0.90 | FFAR1 (0.37) | FFAR1CYP2A6GRM5ACACBRARA | |
| SCHEMBL9508752 | 0.90 | FFAR1 (0.37) | FFAR1CYP2A6GRM5ACACBRARA | |
| SCHEMBL9512399 | 0.89 | FFAR1 (0.36) | FFAR1CYP2A6ACACBRARB | |
| SCHEMBL9512281 | 0.89 | FFAR1 (0.42) | LMNAFFAR1GRM5ACACBGAA | |
| SCHEMBL9509318 | 0.89 | FFAR1 (0.36) | FFAR1CYP2A6ACACBRARB | |
| SCHEMBL9510180 | 0.86 | TSHR (0.40) | FFAR1RARB | |
| SCHEMBL9509936 | 0.86 | FFAR1 (0.40) | FFAR1RARBGAAKMT2AHTT | |
| SCHEMBL9511464 | 0.86 | TSHR (0.40) | FFAR1RARB | |
| SCHEMBL9510169 | 0.85 | TSHR (0.46) | FFAR1RARARARBRARGMEN1 |
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-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | disclosed |