Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 4/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16871031 | 0.97 | PDE3B (0.38) | PDE3BPDE3APTGS2PTGS1APP | |
| SCHEMBL16871134 | 0.90 | PDE3B (0.41) | PDE3BPDE3APTGS2PTGS1APP | |
| SCHEMBL13967517 | 0.84 | PTGS2 (0.46) | PDE3BPDE3APTGS2PTGS1APP | |
| SCHEMBL16871096 | 0.83 | AKR1C3 (0.44) | PDE3BPDE3APTGS2PTGS1APP | |
| SCHEMBL10018702 | 0.82 | PTGS2 (0.48) | PDE3BPDE3APTGS2PTGS1APP | |
| SCHEMBL16871086 | 0.81 | PTGS2 (0.37) | PDE3BPDE3APTGS2PTGS1RPS6KA3 | |
| SCHEMBL10013948 | 0.81 | PTGS2 (0.47) | PDE3BPDE3APTGS2PTGS1APP | |
| SCHEMBL1513694 | 0.79 | ESR1 (0.52) | PDE3BPDE3AAPPCYP3A4CYP2C9 | |
| SCHEMBL16871111 | 0.79 | AKR1C3 (0.39) | PDE3BPDE3APTGS2PTGS1APP | |
| SCHEMBL257801 | 0.79 | ACHE (0.50) | PDE3BPDE3APTGS2PTGS1APP |
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-9428693-B2 | Liquid crystal composition having negative dielectric anisotropy | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) | 2016-08-30 | — | — | US | disclosed |
| US-20150184075-A1 | Liquid Crystal Composition Having Negative Dielectric Anisotropy | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) | 2015-07-02 | — | — | US | disclosed |