Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TNKS | O95271 | 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 | |
|---|---|---|---|---|
| SCHEMBL18580822 | 0.78 | MAPT (0.39) | ACHETSHRKDM4EALDH1A1POLB | |
| SCHEMBL16795392 | 0.78 | KDM4E (0.43) | ACHECACNA1BTSHRGFERBACE1 | |
| SCHEMBL27159868 | 0.77 | KDM4E (0.47) | HIF1AROCK1KDM4EALDH1A1POLB | |
| SCHEMBL16826595 | 0.77 | PARP1 (0.39) | PARP1KDM4EALDH1A1TNKS | |
| SCHEMBL16795302 | 0.75 | ALDH1A1 (0.54) | HIF1ATSHRKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL16858885 | 0.75 | ROCK1 (0.48) | ACHEBACE1ROCK1ALDH1A1 | |
| SCHEMBL18580094 | 0.74 | LTA4H (0.49) | PARP1 | |
| SCHEMBL18580092 | 0.74 | LTA4H (0.49) | PARP1 | |
| SCHEMBL18580625 | 0.74 | LTA4H (0.49) | PARP1 | |
| SCHEMBL18580722 | 0.73 | LPL (0.45) | PARP1KDM4ETNKS |
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-2015086693-A1 | PYRAZOLOPYRIMIDIN-2-YL DERIVATIVES AS JAK INHIBITORS | ALMIRALL, S.A. (ES) | 2015-06-18 | — | — | WO | disclosed |