Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 12/20 | 0.36 |
| ▸ | TYK2 | P29597 | 4/20 | 0.36 |
| ▸ | FLT3 | P36888 | 3/20 | 0.36 |
| ▸ | JAK3 | P52333 | 2/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 11/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.34 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL1073656 | 0.87 | ALK (0.51) | ALKJAK2TYK2JAK3CHRNB2 | |
| Trifluoroacetic Acid SCHEMBL1076031 | 0.80 | ALK (0.48) | ALKJAK2TYK2JAK3CHRNB2 | |
| SCHEMBL13623294 | 0.80 | ALK (0.57) | ALKJAK2TYK2JAK3JAK1 | |
| Trifluoroacetic Acid SCHEMBL1073176 | 0.80 | JAK2 (0.52) | ALKJAK2TYK2FLT3JAK3 | |
| Trifluoroacetic Acid SCHEMBL1075948 | 0.77 | ALK (0.52) | ALKJAK2TYK2FLT3JAK3 | |
| Trifluoroacetic Acid SCHEMBL1073305 | 0.77 | ALK (0.50) | ALKJAK2TYK2FLT3JAK3 | |
| Trifluoroacetic Acid SCHEMBL1076070 | 0.76 | BMPR2 (0.47) | ALKJAK2TYK2FLT3JAK3 | |
| Trifluoroacetic Acid SCHEMBL1073992 | 0.75 | ALK (0.48) | ALKJAK2TYK2JAK3JAK1 | |
| Trifluoroacetic Acid SCHEMBL1074258 | 0.75 | ALK (0.50) | ALKJAK2TYK2JAK3JAK1 | |
| Trifluoroacetic Acid SCHEMBL4358038 | 0.75 | JAK2 (0.42) | ALKJAK2TYK2JAK3CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2274288-A2 | MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | Incyte Corporation (US) | 2011-01-19 | — | — | EP | disclosed |