Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | GCK | P35557 | 2/20 | 0.32 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.31 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9727725 | 0.88 | AKR1B1 (0.32) | AKR1B1ALDH1A1ABCB1HTR1ADRD2 | |
| SCHEMBL9727660 | 0.80 | CGAS (0.31) | LMNA | |
| SCHEMBL9727464 | 0.78 | KDM4E (0.36) | AKR1B1KDM4EALDH1A1KMT2ALMNA | |
| SCHEMBL9727686 | 0.71 | NR3C1 (0.38) | AKR1B1KDM4EALDH1A1POLBKMT2A | |
| SCHEMBL9727307 | 0.67 | L3MBTL1 (0.36) | AKR1B1KDM4EALDH1A1POLBKMT2A | |
| SCHEMBL9727331 | 0.67 | MTNR1A (0.37) | AKR1B1ABCB1HTR1ADRD2 | |
| SCHEMBL9727633 | 0.67 | LTA4H (0.38) | AKR1B1ALDH1A1ABCB1HTR1ADRD2 | |
| SCHEMBL9727700 | 0.67 | MTNR1A (0.35) | AKR1B1ABCB1HTR1ADRD2ABCG2 | |
| SCHEMBL21363788 | 0.67 | MAOB (0.55) | ALDH1A1KMT2AHTR1ADRD2GAA | |
| SCHEMBL9727653 | 0.66 | ABCB1 (0.38) | ABCB1HTR1ADRD2 |
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-5091533-A | Treating allergies, cardiovascular disorders, inflammation | MERCK FROSST CANADA, INC. (CA) | 1992-02-25 | — | — | US | disclosed |
| EP-0447189-A1 | 5-Hydroxy-2,3-dihydrobenzofuran analogs as leukotriene biosynthesis inhibitors | MERCK FROSST CANADA INC. (CA) | 1991-09-18 | — | — | EP | disclosed |