Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL2 | P60568 | 6/20 | 0.54 |
| ▸ | STIM1 | Q13586 | 2/20 | 0.46 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.39 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.39 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.38 |
| ▸ | CSNK1D | P48730 | 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 | |
|---|---|---|---|---|
| SCHEMBL5550479 | 0.89 | IL2 (0.51) | IL2STIM1ORAI1NPC1RAB9A | |
| SCHEMBL5554321 | 0.89 | IL2 (0.51) | IL2STIM1ORAI1NPC1RAB9A | |
| SCHEMBL15395954 | 0.87 | ORAI1 (0.54) | IL2STIM1ORAI1NPC1RAB9A | |
| SCHEMBL15214058 | 0.86 | IL2 (0.50) | IL2STIM1ORAI1NPC1RAB9A | |
| SCHEMBL15395972 | 0.84 | IL2 (0.67) | IL2NPC1RAB9ATP53GAA | |
| SCHEMBL15214056 | 0.83 | IL2 (0.54) | IL2STIM1ORAI1NPC1RAB9A | |
| SCHEMBL5554279 | 0.83 | IL2 (0.53) | IL2STIM1ORAI1ABCB1ABCC1 | |
| SCHEMBL5550900 | 0.82 | IL2 (0.52) | IL2STIM1ORAI1ABCB1ABCC1 | |
| SCHEMBL15395982 | 0.82 | IL2 (0.55) | IL2STIM1ORAI1NPC1RAB9A | |
| SCHEMBL5550956 | 0.81 | ORAI1 (0.67) | IL2STIM1ORAI1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-8518950-B2 | pyrazinyl, pyrimidinyl and pyridazinyl derivatives such asN-[5-(2-Chloro-5-trifluoromethyl-phenyl)-pyrazin-2-yl]-2,6-difluoro-benzamide, used as immunosuppressants for the treatmet or prevent inflammatory and immune disorders | SYNTA PHARMACEUTICALS CORP. (US) | 2013-08-27 | — | — | US | disclosed |