Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 3/20 | 0.48 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.48 |
| ▸ | RARB | P10826 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.43 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.43 |
| ▸ | ACACB | O00763 | 3/20 | 0.43 |
| ▸ | RARA | P10276 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9512415 | 0.98 | ACACB (0.46) | S1PR1S1PR3RARBCYP3A4MEN1 | |
| SCHEMBL9512354 | 0.98 | RARB (0.51) | S1PR1S1PR3RARBCYP3A4MEN1 | |
| SCHEMBL9512515 | 0.96 | RARB (0.52) | S1PR1S1PR3RARBCYP3A4MEN1 | |
| SCHEMBL9509246 | 0.95 | RARB (0.54) | S1PR1S1PR3RARBCYP3A4MEN1 | |
| SCHEMBL9511349 | 0.95 | RARB (0.54) | S1PR1S1PR3RARBCYP3A4MEN1 | |
| SCHEMBL9512222 | 0.95 | RARB (0.54) | S1PR1S1PR3RARBCYP3A4MEN1 | |
| SCHEMBL9512375 | 0.95 | S1PR1 (0.48) | S1PR1S1PR3RARBCYP3A4MEN1 | |
| SCHEMBL9511302 | 0.94 | RARB (0.56) | S1PR1S1PR3RARBCYP3A4MEN1 | |
| SCHEMBL9510183 | 0.94 | RARB (0.56) | S1PR1S1PR3RARBCYP3A4MEN1 | |
| SCHEMBL9508714 | 0.94 | RARB (0.50) | S1PR1S1PR3RARBCYP3A4MEN1 |
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 |