Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | ACACA | Q13085 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | PRKX | P51817 | 1/20 | 0.38 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.37 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL9223434 | 0.94 | FFAR1 (0.41) | S1PR1S1PR3ACACBACACAFFAR4 | |
| SCHEMBL9228167 | 0.94 | S1PR1 (0.46) | S1PR1S1PR3FFAR4FFAR1DRD1 | |
| SCHEMBL9228429 | 0.93 | RARA (0.43) | S1PR1S1PR3ACACBACACAFFAR4 | |
| SCHEMBL9225838 | 0.93 | RARA (0.43) | S1PR1S1PR3ACACBACACAFFAR4 | |
| SCHEMBL9225276 | 0.92 | PTPN11 (0.45) | S1PR1S1PR3FFAR4FFAR1PDK2 | |
| SCHEMBL9221441 | 0.91 | PTPN11 (0.47) | S1PR1S1PR3PDK2MCL1RARA | |
| SCHEMBL9225435 | 0.91 | PTPN11 (0.47) | S1PR1S1PR3PDK2MCL1RARA | |
| SCHEMBL9226301 | 0.91 | PTPN11 (0.47) | S1PR1S1PR3PDK2MCL1RARA | |
| SCHEMBL9220474 | 0.89 | RARB (0.47) | S1PR1S1PR3FFAR4FFAR1MCL1 | |
| SCHEMBL9227579 | 0.89 | PTGS2 (0.43) | FFAR4FFAR1DRD1PTGER4NPC1 |
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-0413785-B1 | LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS | MERCK PATENT GMBH (DE) | 1995-12-20 | — | — | EP | disclosed |