Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13147678 | 0.87 | MAPT (0.54) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL13147676 | 0.87 | PRMT6 (0.45) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL13147685 | 0.87 | SMN1; SMN2 (0.44) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL578046 | 0.85 | SMN1; SMN2 (0.57) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL577649 | 0.81 | SMN1; SMN2 (0.53) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL578325 | 0.76 | SMN1; SMN2 (0.47) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL577980 | 0.74 | KDM4E (0.52) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL578404 | 0.73 | MAPT (0.47) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL578368 | 0.73 | MAPT (0.58) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL578057 | 0.73 | MAPT (0.46) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010118078-A1 | MACROCYCLIC SERINE PROTEASE INHIBITORS | IDENIX PHARMACEUTICALS, INC. (US) | 2010-10-14 | — | — | WO | disclosed |