Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 6/20 | 0.53 |
| ▸ | CA1 | P00915 | 6/20 | 0.53 |
| ▸ | CA2 | P00918 | 6/20 | 0.53 |
| ▸ | CA7 | P43166 | 6/20 | 0.53 |
| ▸ | CA9 | Q16790 | 6/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | IAPP | P10997 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27903621 | 0.83 | TSHR (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL30410323 | 0.81 | TSHR (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL14360117 | 0.81 | TSHR (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL4017348 | 0.80 | CA12 (0.48) | CA12CA1CA2CA7CA9 | |
| SCHEMBL27520483 | 0.77 | CA12 (0.55) | CA12CA1CA2CA7CA9 | |
| SCHEMBL27446763 | 0.76 | TSHR (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL27414114 | 0.75 | CA12 (0.45) | CA12CA1CA2CA7CA9 | |
| SCHEMBL3183513 | 0.75 | TSHR (0.68) | TSHRALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL27540219 | 0.74 | TSHR (0.66) | TSHRALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL4420191 | 0.74 | CA12 (0.50) | CA12CA1CA2CA7CA9 |
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-105085264-A | Asymmetric synthesis method for tanshinol ester derivative | UNIV SHANGHAI JIAOTONG | 2015-11-25 | — | — | CN | disclosed |