Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TRPV4 | Q9HBA0 | 3/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | MGAT3 | Q09327 | 1/20 | 0.35 |
| ▸ | MGAT2 | Q10469 | 1/20 | 0.35 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | TPH1 | P17752 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 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 | |
|---|---|---|---|---|
| SCHEMBL7686665 | 0.91 | KIF11 (0.39) | ALDH1A1MAPK1TRPV4KIF11TPH1 | |
| SCHEMBL7754941 | 0.69 | TRPV4 (0.39) | L3MBTL1ALDH1A1TRPV4MEP1BCYP2D6 | |
| SCHEMBL7754946 | 0.69 | L3MBTL1 (0.40) | L3MBTL1TRPV4MEP1B | |
| SCHEMBL7220418 | 0.69 | ALDH1A1 (0.40) | L3MBTL1ALDH1A1TRPV4MEP1B | |
| SCHEMBL7220168 | 0.69 | FNTA (0.37) | L3MBTL1ALDH1A1TRPV4MEP1B | |
| SCHEMBL7680485 | 0.66 | GPR119 (0.43) | ALDH1A1RAB9ATPH1MAPT | |
| SCHEMBL7680493 | 0.65 | GPR119 (0.42) | ALDH1A1RAB9ATPH1MAPT | |
| SCHEMBL3199069 | 0.62 | ATM (0.64) | L3MBTL1ALDH1A1MAPK1MEP1BMAPT | |
| SCHEMBL7686709 | 0.62 | CYP11B1 (0.36) | — | |
| SCHEMBL20702465 | 0.61 | AR (0.52) | L3MBTL1ALDH1A1MEP1BMAPTPKM |
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 |
|---|---|---|---|---|---|---|---|
| US-6350755-B1 | PEPTIDOMIMETIC COMPOUNDS THAT DO NOT HAVE A THIOL MOIETY; THERAPY OF ARTERIOSCLEROSIS AND DIABETIC VASCULAR PATHOLOGIES; | MERCK & CO., INC. | 2002-02-26 | — | — | US | disclosed |