Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR4 | Q5NUL3 | 15/20 | 0.52 |
| ▸ | FFAR1 | O14842 | 9/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.47 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.47 |
| ▸ | NTRK2 | Q16620 | 2/20 | 0.47 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.40 |
| ▸ | MST1R | Q04912 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20246096 | 0.73 | FFAR4 (0.54) | FFAR4FFAR1CA9 | |
| SCHEMBL21011150 | 0.69 | HPGD (0.55) | CA12CA9CLK4DYRK1BNTRK2 | |
| SCHEMBL21731339 | 0.69 | OGA (0.57) | CA12CA9CLK4DYRK1BNTRK2 | |
| SCHEMBL4144745 | 0.68 | FFAR4 (0.55) | FFAR4FFAR1 | |
| SCHEMBL6028323 | 0.68 | HSD17B10 (0.54) | CA12CA9CLK4DYRK1BNTRK2 | |
| SCHEMBL20099002 | 0.68 | FFAR4 (0.46) | FFAR4FFAR1 | |
| SCHEMBL4818277 | 0.67 | CA12 (1.00) | CA12CA9CLK4DYRK1BNTRK2 | |
| SCHEMBL14896 | 0.67 | CA12 (1.00) | CA12CA9CLK4DYRK1BNTRK2 | |
| SCHEMBL29355184 | 0.67 | CA12 (1.00) | CA12CA9CLK4DYRK1BNTRK2 | |
| SCHEMBL6028541 | 0.67 | ALDH1A1 (0.53) | CA12CA9CLK4DYRK1BNTRK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2976339-B1 | GEMINALLY SUBSTITUTED CYANOETHYLPYRAZOLO PYRIDONES AS JANUS KINASE INHIBITORS | MERCK SHARP & DOHME (US) | 2018-06-27 | — | — | EP | disclosed |
| US-9957264-B2 | Geminally substituted cyanoethylpyrazolo pyridones as Janus kinase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2018-05-01 | — | — | US | disclosed |