Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 8/20 | 0.63 |
| ▸ | CA9 | Q16790 | 7/20 | 0.63 |
| ▸ | CA1 | P00915 | 6/20 | 0.63 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 4/20 | 0.43 |
| ▸ | CA5A | P35218 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | AGXT | P21549 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8374307 | 0.88 | CA2 (0.55) | CA2CA9CA1TSHRIDO1 | |
| SCHEMBL9861122 | 0.88 | CA2 (0.55) | CA2CA9CA1TSHRIDO1 | |
| SCHEMBL9861791 | 0.86 | CA2 (0.53) | CA2CA9CA1TSHRCA12 | |
| SCHEMBL5467517 | 0.83 | CA2 (0.59) | CA2CA9CA1TSHRIDO1 | |
| SCHEMBL5078811 | 0.83 | CA2 (0.59) | CA2CA9CA1TSHRIDO1 | |
| SCHEMBL6212518 | 0.82 | CA2 (0.49) | CA2CA9CA1TSHRIDO1 | |
| SCHEMBL28624040 | 0.81 | CA2 (0.68) | CA2CA9CA1TSHRIDO1 | |
| SCHEMBL561014 | 0.81 | CA2 (0.68) | CA2CA9CA1TSHRIDO1 | |
| SCHEMBL2932534 | 0.81 | CA2 (0.57) | CA2CA9CA1TSHRIDO1 | |
| SCHEMBL10709450 | 0.81 | CA2 (0.57) | CA2CA9CA1TSHRIDO1 |
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-108586310-A | The catalysis oxidation synthetic method of 3- sulfydryl indole class compounds | 浙江工业大学 | 2018-09-28 | — | — | CN | disclosed |