Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 11/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.50 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20029560 | 1.00 | PTGS2 (0.51) | PTGS2PTGS1ACHEPDE3BPDE3A | |
| SCHEMBL13301268 | 0.98 | PTGS2 (0.53) | PTGS2PTGS1ACHEPDE3BPDE3A | |
| SCHEMBL17570168 | 0.91 | ACHE (0.46) | PTGS2PTGS1ACHEPDE3BPDE3A | |
| SCHEMBL172423 | 0.89 | ACHE (0.48) | PTGS2PTGS1ACHEPDE3BPDE3A | |
| SCHEMBL22048103 | 0.84 | MEN1 (0.44) | PTGS2PTGS1PDE3BPDE3A | |
| SCHEMBL4549715 | 0.83 | PTGS2 (0.40) | PTGS2PTGS1ACHEPDE3BPDE3A | |
| SCHEMBL17548830 | 0.83 | PTGS2 (0.40) | PTGS2PTGS1ACHEPDE3BPDE3A | |
| SCHEMBL18779837 | 0.82 | RAB9A (0.40) | PTGS2PTGS1ACHE | |
| SCHEMBL17359262 | 0.81 | RPS6KA3 (0.46) | PTGS2PTGS1ACHEPDE3BPDE3A | |
| SCHEMBL17550730 | 0.81 | MEN1 (0.44) | PTGS2PTGS1ACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-10767113-B2 | Liquid crystal compound containing 2,3,4-trisubstituted benzene and composition thereof | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) | 2020-09-08 | — | — | US | disclosed |
| US-20180094191-A1 | LIQUID CRYSTAL COMPOUND CONTAINING 2,3,4-TRISUBSTITUTED BENZENE AND COMPOSITION THEREOF | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO LTD (CN) | 2018-04-05 | — | — | US | disclosed |