Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9727668 | 0.86 | TDP1 (0.36) | TDP1L3MBTL1 | |
| SCHEMBL9727665 | 0.85 | L3MBTL1 (0.38) | AKR1B1L3MBTL1MEN1KMT2A | |
| SCHEMBL9727331 | 0.81 | MTNR1A (0.37) | AKR1B1 | |
| SCHEMBL9727653 | 0.80 | ABCB1 (0.38) | — | |
| SCHEMBL9727777 | 0.78 | AKR1B1 (0.35) | KDM4EALDH1A1LMNAAKR1B1KMT2A | |
| SCHEMBL9727725 | 0.74 | AKR1B1 (0.32) | ALDH1A1AKR1B1BCHETDP1L3MBTL1 | |
| SCHEMBL5502488 | 0.71 | MAOA (0.40) | — | |
| SCHEMBL9727700 | 0.69 | MTNR1A (0.35) | AKR1B1TDP1L3MBTL1 | |
| SCHEMBL9727633 | 0.69 | LTA4H (0.38) | ALDH1A1AKR1B1DUSP3 | |
| SCHEMBL9727620 | 0.68 | CCR5 (0.38) | KDM4EALDH1A1LMNAHTTSMN1; SMN2 |
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 |