Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.48 |
| ▸ | HTR7 | P34969 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | TFPI2 | P48307 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | SCD | O00767 | 7/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | HTR1F | P30939 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.38 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.37 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7149460 | 0.89 | CCR3 (0.46) | HTR2AHTR7KCNH2TFPI2HTR2C | |
| SCHEMBL6589098 | 0.87 | HTR1A (0.54) | HTR2AHTR7KCNH2SCDHTR1A | |
| SCHEMBL31434301 | 0.83 | HTR2A (0.45) | HTR2AHTR7KCNH2TFPI2HTR2C | |
| SCHEMBL21525109 | 0.80 | HTR2A (0.43) | HTR2AHTR7KCNH2TFPI2HTR2C | |
| SCHEMBL24109849 | 0.79 | HTR2A (0.43) | HTR2AHTR7KCNH2TFPI2HTR2C | |
| SCHEMBL31196415 | 0.79 | HTR2A (0.40) | HTR2AHTR7KCNH2TFPI2HTR2C | |
| SCHEMBL15520260 | 0.78 | SCD (0.49) | HTR2AHTR7KCNH2HTR2CSCD | |
| SCHEMBL31196468 | 0.78 | TFPI2 (0.46) | HTR2AHTR7KCNH2TFPI2HTR2C | |
| SCHEMBL31196274 | 0.78 | TFPI2 (0.46) | HTR2AHTR7KCNH2TFPI2HTR2C | |
| SCHEMBL31196245 | 0.78 | TFPI2 (0.46) | HTR2AHTR7KCNH2TFPI2HTR2C |
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-115073426-A | Pyrimidine heterocyclic compound and preparation method and application thereof | 上海科州药物研发有限公司 | 2022-09-20 | — | — | CN | disclosed |