Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.59 |
| ▸ | HTR2B | P41595 | 2/20 | 0.59 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.53 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 2/20 | 0.52 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL19297335 | 1.00 | HTR2C (0.59) | HTR2CHTR2BCHRNB2CHRNA4HRH1 | |
| SCHEMBL22953684 | 1.00 | HTR2C (0.59) | HTR2CHTR2BCHRNB2CHRNA4HRH1 | |
| Hydrochloric Acid SCHEMBL25355267 | 0.98 | HTR2C (0.58) | HTR2CHTR2BCHRNB2CHRNA4HRH1 | |
| SCHEMBL578873 | 0.89 | HRH1 (0.66) | HTR2CHTR2BHRH1ROCK1 | |
| Hydrochloric Acid SCHEMBL5437744 | 0.87 | HRH1 (0.63) | HTR2CHTR2BHRH1ROCK1 | |
| SCHEMBL15300747 | 0.84 | SLC6A4 (0.53) | HTR2CHTR2B | |
| SCHEMBL7000861 | 0.83 | PRKCZ (0.56) | HTR2CHTR2BCHRNB2CHRNA4HRH1 | |
| SCHEMBL3133920 | 0.83 | PRKCZ (0.56) | HTR2CHTR2BCHRNB2CHRNA4HRH1 | |
| SCHEMBL4067092 | 0.83 | PRKCZ (0.56) | HTR2CHTR2BCHRNB2CHRNA4HRH1 | |
| Hydrochloric Acid SCHEMBL17541992 | 0.82 | SLC6A4 (0.52) | HTR2CHTR2B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021018046-A1 | SGLTS/DPP4 INHIBITOR AND APPLICATION THEREOF | 南京明德新药研发有限公司 | 2021-02-04 | — | — | WO | disclosed |