Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 15/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | PTGIS | Q16647 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19915935 | 0.81 | IDO1 (0.39) | TBXAS1IDO1 | |
| SCHEMBL21060548 | 0.79 | TBXAS1 (0.39) | TBXAS1PTGS1PTGS2PTGISIDO1 | |
| SCHEMBL19915855 | 0.76 | IDO1 (0.55) | TBXAS1PTGS1PTGS2PTGISIDO1 | |
| SCHEMBL21060532 | 0.72 | IDO1 (0.50) | TBXAS1PTGS1PTGS2PTGISIDO1 | |
| SCHEMBL21816313 | 0.69 | TBXAS1 (0.39) | TBXAS1PTGS1PTGS2PTGISIDO1 | |
| SCHEMBL5792448 | 0.68 | TBXAS1 (0.51) | TBXAS1PTGS1PTGS2PTGISIDO1 | |
| SCHEMBL19915857 | 0.65 | IDO1 (0.39) | TBXAS1IDO1 | |
| SCHEMBL19915741 | 0.62 | IDO1 (0.48) | TBXAS1PTGS1PTGS2PTGISIDO1 | |
| SCHEMBL18137410 | 0.62 | TBXAS1 (0.44) | TBXAS1 | |
| SCHEMBL11041767 | 0.61 | TBXAS1 (0.67) | TBXAS1PTGS1PTGS2PTGIS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018036414-A1 | FUSED HETEROCYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 北京诺诚健华医药科技有限公司 | 2018-03-01 | — | — | WO | disclosed |