Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 9/20 | 0.34 |
| ▸ | CA2 | P00918 | 9/20 | 0.34 |
| ▸ | CA9 | Q16790 | 9/20 | 0.34 |
| ▸ | CA12 | O43570 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | LPAR3 | Q9UBY5 | 6/20 | 0.33 |
| ▸ | LPAR2 | Q9HBW0 | 5/20 | 0.33 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.33 |
| ▸ | CA3 | P07451 | 2/20 | 0.33 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
| ▸ | CA6 | P23280 | 2/20 | 0.33 |
| ▸ | CA5A | P35218 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16544485 | 0.98 | CA1 (0.33) | CA1CA2CA9CA12MEN1 | |
| SCHEMBL9575811 | 0.96 | MEN1 (0.36) | CA1CA2CA9CA12MEN1 | |
| SCHEMBL28203345 | 0.96 | MEN1 (0.36) | CA1CA2CA9CA12MEN1 | |
| SCHEMBL27975816 | 0.91 | MEN1 (0.37) | CA1CA2MEN1KMT2ATHRB | |
| SCHEMBL16544486 | 0.86 | — | — | |
| SCHEMBL8837037 | 0.84 | TSHR (0.33) | — | |
| SCHEMBL28306447 | 0.82 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL16544489 | 0.79 | — | — | |
| SCHEMBL16548122 | 0.78 | CYP4F2 (0.34) | — | |
| SCHEMBL6161219 | 0.76 | TSHR (0.36) | CA1CA2CA9CA12MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110563552-A | Comprehensive utilization method of cyclohexanone light oil | 中国石油化工股份有限公司 | 2019-12-13 | — | — | CN | disclosed |