Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.31 |
| ▸ | SELE | P16581 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.30 |
| ▸ | SMO | Q99835 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7109193 | 0.79 | ICAM1 (0.40) | ICAM1SELECNR2MAP2K1SMO | |
| SCHEMBL7108469 | 0.76 | CNR2 (0.41) | CYP2C19HIF1AICAM1SELECNR2 | |
| SCHEMBL7107198 | 0.73 | — | — | |
| SCHEMBL7106667 | 0.73 | KCNA5 (0.31) | — | |
| SCHEMBL7105165 | 0.71 | MAP2K1 (0.41) | CYP2C19HIF1AICAM1SELECNR2 | |
| SCHEMBL7110604 | 0.70 | LMNA (0.41) | CYP2C19HIF1AICAM1SELECNR2 | |
| SCHEMBL7104658 | 0.68 | SMN1; SMN2 (0.35) | CYP2C19 | |
| SCHEMBL590665 | 0.68 | SIRT6 (0.42) | — | |
| SCHEMBL18230701 | 0.65 | SIRT6 (0.42) | ICAM1SELECNR2MAP2K1SMO | |
| SCHEMBL28237026 | 0.65 | SMN1; SMN2 (0.54) | CYP2C19 |
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-1001944-B1 | PYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM | AVENTIS PHARMA SA (FR) | 2003-10-01 | — | — | EP | claimed |