Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 3/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.30 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.30 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.30 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20005223 | 0.99 | GRM5 (0.34) | GRM5PDE3BPDE3AMEN1KMT2A | |
| SCHEMBL20004795 | 0.94 | GRM5 (0.34) | GRM5PDE3BPDE3AAKR1C3AKR1C2 | |
| SCHEMBL20005288 | 0.94 | PDE3B (0.32) | PDE3BPDE3AAKR1C3AKR1C2AKR1B10 | |
| SCHEMBL20006922 | 0.91 | MEN1 (0.39) | GRM5AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL20004646 | 0.91 | KDM1A (0.31) | PDE3BPDE3A | |
| SCHEMBL20005289 | 0.90 | AKR1C3 (0.33) | GRM5PDE3BPDE3AAKR1C3AKR1C2 | |
| SCHEMBL19999441 | 0.90 | GRM5 (0.34) | GRM5PDE3BPDE3AAKR1C3AKR1C2 | |
| SCHEMBL20005252 | 0.89 | PDE3B (0.33) | PDE3BPDE3ARPS6KA3 | |
| SCHEMBL20006881 | 0.89 | MEN1 (0.40) | GRM5AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL20004620 | 0.88 | CYP11B1 (0.31) | — |
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-3299439-A1 | LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC Corporation (JP) | 2018-03-28 | — | — | EP | disclosed |