Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.51 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 5/20 | 0.48 |
| ▸ | CA2 | P00918 | 5/20 | 0.48 |
| ▸ | CA9 | Q16790 | 5/20 | 0.48 |
| ▸ | CA4 | P22748 | 3/20 | 0.48 |
| ▸ | CA7 | P43166 | 3/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | NAMPT | P43490 | 4/20 | 0.46 |
| ▸ | HTR6 | P50406 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.45 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.45 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13241500 | 0.84 | HSD11B1 (0.53) | HSD11B1CA1CA2CA9CA4 | |
| SCHEMBL11335297 | 0.81 | HSD11B1 (0.50) | HSD11B1CA1CA2CA9CA4 | |
| SCHEMBL28379517 | 0.80 | CA2 (0.58) | HSD11B1CA1CA2CA9CA4 | |
| SCHEMBL6001994 | 0.80 | HTR6 (0.59) | HSD11B1CA1CA2CA9CA4 | |
| SCHEMBL8964467 | 0.80 | GAA (0.60) | HSD11B1CA1CA2CA9CA7 | |
| SCHEMBL12336792 | 0.80 | HTR6 (0.58) | HSD11B1MAPTNAMPTHTR6KDM4E | |
| SCHEMBL30893040 | 0.80 | GAA (0.60) | HSD11B1CA1CA2CA9CA7 | |
| SCHEMBL27827989 | 0.79 | CA1 (0.53) | PSIP1CA1CA2CA9CA4 | |
| SCHEMBL1713160 | 0.79 | HTR6 (0.57) | HSD11B1MAPTHTR6KDM4ESMN1; SMN2 | |
| SCHEMBL31092469 | 0.79 | HTR6 (0.57) | HSD11B1MAPTHTR6KDM4ESMN1; SMN2 |
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-109734904-A | A kind of three circle heterocyclic ring ring-opening polymerisation of organic concerted catalysis without metal catalyst system | 中国科学院青岛生物能源与过程研究所 | 2019-05-10 | — | — | CN | disclosed |