Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 2/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12943769 | 0.81 | SIGMAR1 (0.39) | ALDH1A1HRH3 | |
| SCHEMBL4106380 | 0.79 | JAK2 (0.53) | JAK2NTRK1KDM4EALDH1A1NPC1 | |
| SCHEMBL4293207 | 0.76 | JAK2 (0.53) | JAK2NTRK1KDM4EALDH1A1KDM1A | |
| SCHEMBL4104900 | 0.75 | JAK2 (0.50) | JAK2NTRK1KDM4EALDH1A1KDM1A | |
| SCHEMBL12943762 | 0.73 | POLB (0.57) | KDM4EALDH1A1NPC1RAB9AHRH3 | |
| SCHEMBL1075746 | 0.72 | JAK2 (0.55) | JAK2NTRK1KDM4EALDH1A1HRH3 | |
| SCHEMBL4306311 | 0.71 | NPC1 (0.49) | KDM4EALDH1A1NPC1RAB9ALTA4H | |
| SCHEMBL20877797 | 0.70 | MEN1 (0.54) | KDM4EALDH1A1NPC1RAB9ALTA4H | |
| SCHEMBL4100620 | 0.70 | NPC1 (0.48) | KDM4EALDH1A1NPC1RAB9ALTA4H | |
| SCHEMBL15039527 | 0.70 | CHRNB2 (0.46) | MEN1KMT2APARP1 |
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-2451812-B1 | SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS TRK KINASE INHIBITORS | ARRAY BIOPHARMA INC (US) | 2017-11-08 | — | — | EP | disclosed |