Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 3/20 | 0.41 |
| ▸ | GPR55 | Q9Y2T6 | 8/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.39 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.38 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.38 |
| ▸ | GRK6 | P43250 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15436246 | 1.00 | NTRK1 (0.41) | NTRK1GPR55JAK2JAK3LIMK1 | |
| SCHEMBL1367669 | 0.79 | GPR55 (0.46) | NTRK1GPR55JAK2JAK3LIMK1 | |
| SCHEMBL1367667 | 0.79 | GPR55 (0.46) | NTRK1GPR55JAK2JAK3LIMK1 | |
| SCHEMBL13313087 | 0.78 | AURKA (0.52) | NTRK1GPR55AURKAAURKB | |
| SCHEMBL3557473 | 0.78 | AURKA (0.52) | NTRK1GPR55AURKAAURKB | |
| SCHEMBL1365913 | 0.78 | NTRK1 (0.47) | NTRK1GPR55JAK2JAK3LIMK1 | |
| SCHEMBL3515072 | 0.78 | AURKA (0.52) | NTRK1GPR55AURKAAURKB | |
| SCHEMBL1365910 | 0.78 | NTRK1 (0.47) | NTRK1GPR55JAK2JAK3LIMK1 | |
| SCHEMBL1366562 | 0.77 | GPR55 (0.48) | NTRK1GPR55JAK2JAK3LIMK1 | |
| SCHEMBL1366564 | 0.77 | GPR55 (0.48) | NTRK1GPR55JAK2JAK3LIMK1 |
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-2394999-B1 | AMINOPYRAZINE DERIVATIVE AND MEDICINE | NIPPON SHINYAKU CO LTD (JP) | 2014-01-29 | — | — | EP | disclosed |
| EP-2394999-A1 | AMINOPYRAZINE DERIVATIVE AND MEDICINE | Nippon Shinyaku Co., Ltd. (JP) | 2011-12-14 | — | — | EP | disclosed |