Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.47 |
| ▸ | STAT3 | P40763 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | MMP1 | P03956 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10695075 | 0.99 | PDE4A (0.48) | PDE4APDE4BPDE4CPDE4DALDH1A1 | |
| SCHEMBL27917987 | 0.85 | MMP12 (0.52) | LMNAMAPTL3MBTL1CYP1A2LTA4H | |
| SCHEMBL10693648 | 0.84 | ADRB2 (0.57) | ALDH1A1LMNASTAT3KDM4ECYP3A4 | |
| SCHEMBL11111407 | 0.78 | STAT3 (0.52) | ALDH1A1LMNAABCB1STAT3KDM4E | |
| SCHEMBL7250015 | 0.77 | ADRB2 (0.77) | ALDH1A1LMNAKDM4ECYP3A4ADRB2 | |
| SCHEMBL7244493 | 0.77 | ADRB2 (0.77) | ALDH1A1LMNAKDM4ECYP3A4ADRB2 | |
| SCHEMBL7246801 | 0.77 | ADRB2 (0.77) | ALDH1A1LMNAKDM4ECYP3A4ADRB2 | |
| Hydrochloric Acid SCHEMBL7336909 | 0.77 | ADRB2 (0.76) | ALDH1A1LMNAKDM4ECYP3A4ADRB2 | |
| Hydrochloric Acid SCHEMBL7246236 | 0.77 | ADRB2 (0.76) | ALDH1A1LMNAKDM4ECYP3A4ADRB2 | |
| SCHEMBL10348774 | 0.76 | ALDH1A1 (0.58) | PDE4APDE4BPDE4CPDE4DALDH1A1 |
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-0253592-A1 | A method for epimerizing an optically active benzylalcohol derivative | TANABE SEIYAKU CO., LTD. (JP) | 1988-01-20 | — | — | EP | disclosed |