Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 2/20 | 0.47 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.47 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.47 |
| ▸ | LRRK2 | Q5S007 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL27618506 | 0.85 | HTR6 (0.47) | HTR6S1PR5PTGDRLRRK2MAPT | |
| SCHEMBL5259717 | 0.83 | MAPT (0.60) | HTR6S1PR5MAPTKDM4EALDH1A1 | |
| SCHEMBL2478773 | 0.81 | HTR6 (0.67) | HTR6LRRK2MAPT | |
| SCHEMBL2767656 | 0.81 | KDM4E (0.46) | HTR6S1PR5PTGDRLRRK2MAPT | |
| SCHEMBL2766477 | 0.79 | HTR1A (0.59) | HTR6S1PR5LRRK2 | |
| SCHEMBL5261930 | 0.79 | TLR9 (0.51) | S1PR5MAPTKDM4EALDH1A1GAA | |
| SCHEMBL31181068 | 0.79 | TLR9 (0.51) | S1PR5MAPTKDM4EALDH1A1GAA | |
| SCHEMBL27637687 | 0.79 | HTR6 (0.45) | HTR6S1PR5PTGDRLRRK2MAPT | |
| SCHEMBL2769519 | 0.78 | MAPT (0.51) | S1PR5MAPTKDM4EALDH1A1GAA | |
| SCHEMBL17893596 | 0.78 | HTR6 (0.47) | HTR6S1PR5LRRK2MAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-100562319-C | 2-cyanopyrrole and pyrimidine and its pharmaceutical use | NOVARTIS AG (CH) | 2009-11-25 | — | — | CN | disclosed |
| CN-1756553-A | 2-cyanopyrrolopyrimidines and pharmaceutical uses thereof | NOVARTIS AG (CH) | 2006-04-05 | — | — | CN | disclosed |