Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 2/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL30300596 | 1.00 | HTR1D (0.47) | HTR1DGRIN2BHTR1AHTR7FYN | |
| SCHEMBL24740615 | 0.98 | HTR1D (0.48) | HTR1DGRIN2BHTR1AHTR7FYN | |
| SCHEMBL29113501 | 0.97 | GRIN2B (0.45) | HTR1DGRIN2BHTR1AHTR7FYN | |
| SCHEMBL30612416 | 0.97 | GRIN2B (0.45) | HTR1DGRIN2BHTR1AHTR7FYN | |
| SCHEMBL467492 | 0.92 | HTR1D (0.44) | HTR1DGRIN2BBRD4ATAD2L3MBTL3 | |
| SCHEMBL19633006 | 0.92 | HTR1D (0.44) | HTR1DGRIN2BBRD4ATAD2L3MBTL3 | |
| SCHEMBL12006215 | 0.88 | FYN (0.55) | HTR1DGRIN2BHTR1AHTR7FYN | |
| SCHEMBL11832235 | 0.86 | FYN (0.58) | HTR1DGRIN2BHTR1AHTR7FYN | |
| SCHEMBL24740620 | 0.86 | GAA (0.43) | HTR1DGRIN2BBRD4ATAD2FAAH | |
| SCHEMBL2060177 | 0.82 | FAAH (0.57) | HTR1DGRIN2BHTR1AHTR7FYN |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117412971-A | Pyrrolopyrimidine derivatives containing pyrazine structures | 微境生物医药科技(上海)有限公司 | 2024-01-16 | — | — | CN | disclosed |
| CN-117222649-A | Pyrrolopyrimidine derivatives, process for their preparation and their use | 微境生物医药科技(上海)有限公司 | 2023-12-12 | — | — | CN | disclosed |
| CN-109810111-B | Pyrazolopyrimidine compound, and preparation method and application thereof | 上海医药集团股份有限公司 | 2023-10-27 | — | — | CN | disclosed |
| CN-116848118-A | Pyrazolo [3,4-d ] pyrimidin-3-one derivatives as Wee-1 inhibitors | 微境生物医药科技(上海)有限公司 | 2023-10-03 | — | — | CN | disclosed |
| CN-111039941-B | Nitrogen-containing heterocyclic compound, preparation method and application thereof | 上海医药集团股份有限公司 | 2023-03-21 | — | — | CN | disclosed |
| WO-2022171128-A1 | PYRAZOLO[3,4-D]PYRIMIDINE-3-KETONE DERIVATIVE SERVING AS WEE-1 INHIBITOR | 微境生物医药科技(上海)有限公司 | 2022-08-18 | — | — | WO | disclosed |
| CN-111039941-A | Nitrogen-containing heterocyclic compound, preparation method and application thereof | 上海医药集团股份有限公司 | 2020-04-21 | — | — | CN | disclosed |