Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 5/20 | 0.53 |
| ▸ | CTSK | P43235 | 5/20 | 0.53 |
| ▸ | CTSL | P07711 | 4/20 | 0.53 |
| ▸ | CTSB | P07858 | 3/20 | 0.53 |
| ▸ | IDH2 | P48735 | 1/20 | 0.53 |
| ▸ | GALR2 | O43603 | 3/20 | 0.50 |
| ▸ | GALR1 | P47211 | 2/20 | 0.50 |
| ▸ | SYK | P43405 | 2/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 5/20 | 0.43 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19873470 | 0.82 | ROCK2 (0.48) | CTSSCTSKCTSLCTSBGALR2 | |
| SCHEMBL16927939 | 0.81 | MEN1 (0.55) | CTSSCTSKGALR2CHRNA7 | |
| SCHEMBL16928568 | 0.81 | IDH2 (0.57) | IDH2RAB9A | |
| SCHEMBL19873499 | 0.78 | IDH2 (0.47) | CTSSCTSKCTSLIDH2 | |
| SCHEMBL19873473 | 0.78 | MEN1 (0.51) | CTSSCTSKGALR2CHRNA7 | |
| SCHEMBL19873503 | 0.77 | CHRNA7 (0.46) | CTSSCTSKCTSLCTSBGALR2 | |
| SCHEMBL19873465 | 0.75 | PIM1 (0.44) | CTSSCTSKCTSLCTSBGALR2 | |
| SCHEMBL19873458 | 0.75 | ABL1 (0.48) | GALR2CHRNA7RAB9A | |
| SCHEMBL19053281 | 0.74 | CTSS (0.57) | CTSSCTSKCTSLCTSBGALR2 | |
| SCHEMBL19873453 | 0.73 | ABL1 (0.49) | GALR2CHRNA7 |
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-3351538-A1 | TRIAZINE COMPOUNDS AND COMPOSITIONS THEREOF AND METHODS FOR TREATING MALARIA AND CHEMOPROPHYLAXIS | The United States of America, as represented by The Secretary of The Army, on behalf of Walter Reed Army Institute of Research (US) | 2018-07-25 | — | — | EP | disclosed |
| EP-2970153-B1 | TRIAZINE COMPOUNDS AND COMPOSITIONS THEREOF AND METHODS FOR TREATING MALARIA AND CHEMOPROPHYLAXIS | THE US SECRETARY OF THE ARMY ON BEHALF OF WALTER REED ARMY INSTITUTE OF RESEARCH (US) | 2018-02-21 | — | — | EP | disclosed |