Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.33 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12984381 | 0.82 | AGBL2 (0.47) | RAB9ADAOSRCAGBL2HTR2A | |
| SCHEMBL29535595 | 0.82 | AGBL2 (0.47) | RAB9ADAOSRCAGBL2HTR2A | |
| SCHEMBL12986732 | 0.81 | RAB9A (0.40) | RAB9ADAOSRCAGBL2HTR2A | |
| SCHEMBL1979245 | 0.81 | RAB9A (0.40) | RAB9ADAOSRCAGBL2HTR2A | |
| SCHEMBL161772 | 0.79 | CA1 (0.39) | RAB9ADAOSRCAGBL2HTR2A | |
| SCHEMBL9661934 | 0.78 | RAB9A (0.66) | RAB9A | |
| SCHEMBL7451769 | 0.77 | — | — | |
| SCHEMBL23742179 | 0.77 | AOC3 (0.43) | SRCCCNE1CDK2NTRK1 | |
| SCHEMBL15174174 | 0.77 | TYK2 (0.43) | RAB9ADAOADORA2AGRM5CXCR2 | |
| SCHEMBL24086542 | 0.77 | RAB9A (0.37) | RAB9ADAOSRCAGBL2HTR2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3845531-A1 | SUBSTITUTED PYRAZOLE FUSED RING DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | Applied Pharmaceutical Science, Inc. (CN) | 2021-07-07 | — | — | EP | disclosed |
| WO-2020064009-A1 | SUBSTITUTED PYRAZOLE FUSED RING DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 北京志健金瑞生物医药科技有限公司 | 2020-04-02 | — | — | WO | disclosed |