Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.31 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.31 |
| ▸ | ITGAL | P20701 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | ADK | P55263 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL220723 | 0.87 | — | — | |
| SCHEMBL2156749 | 0.85 | — | — | |
| SCHEMBL15577215 | 0.79 | DAO (0.37) | DAO | |
| Benzothiophene SCHEMBL28556052 | 0.77 | TRPA1 (0.42) | DAOTRPA1CA1CA2ITGB2 | |
| Indole SCHEMBL27986465 | 0.74 | AHR (0.59) | TRPA1CA1CA2ITGB2ICAM1 | |
| Benzene SCHEMBL27958890 | 0.73 | GPR35 (0.37) | DAO | |
| SCHEMBL7627620 | 0.71 | TRPA1 (0.38) | TRPA1CA1CA2ITGB2ICAM1 | |
| Thiophene SCHEMBL716369 | 0.70 | GPR35 (0.33) | — | |
| Thiophene SCHEMBL15754567 | 0.70 | GPR35 (0.33) | — | |
| Pyrrole SCHEMBL29290733 | 0.68 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109880067-A | One kind is containing double cable conjugated polymers of benzene thiophene-Thienopyrroles diketone type and preparation method thereof | 江西省科学院应用化学研究所 | 2019-06-14 | — | — | CN | claimed |
| CN-109880067-A | One kind is containing double cable conjugated polymers of benzene thiophene-Thienopyrroles diketone type and preparation method thereof | 江西省科学院应用化学研究所 | 2019-06-14 | — | — | CN | disclosed |
| CN-109880067-A | One kind is containing double cable conjugated polymers of benzene thiophene-Thienopyrroles diketone type and preparation method thereof | 江西省科学院应用化学研究所 | 2019-06-14 | — | — | CN | disclosed |
| CN-109880067-A | One kind is containing double cable conjugated polymers of benzene thiophene-Thienopyrroles diketone type and preparation method thereof | 江西省科学院应用化学研究所 | 2019-06-14 | — | — | CN | disclosed |