Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 2/20 | 0.37 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14936104 | 1.00 | GSR (0.41) | GSRCHRM2CHRM1HTR1AADRA2A | |
| SCHEMBL14945247 | 0.91 | GSR (0.40) | GSRCHRM2CHRM1BLMPABPC1 | |
| SCHEMBL14945251 | 0.91 | GSR (0.40) | GSRCHRM2CHRM1BLMPABPC1 | |
| SCHEMBL14936382 | 0.83 | GSR (0.44) | GSRCHRM2CHRM1BLMCHRM4 | |
| SCHEMBL14936137 | 0.83 | KDM4E (0.44) | GSRCHRM2CHRM1HTR1AADRA2A | |
| SCHEMBL14945167 | 0.81 | ALDH1A1 (0.40) | GSRCHRM2CHRM1HTR1AADRA2A | |
| SCHEMBL26325733 | 0.80 | ACACB (0.35) | TSHR | |
| SCHEMBL14945583 | 0.80 | ACACB (0.35) | TSHR | |
| SCHEMBL14945165 | 0.79 | GSR (0.44) | GSRCHRM2CHRM1HTR1AADRA2A | |
| SCHEMBL14945409 | 0.79 | DPP4 (0.40) | OPRM1MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112739705-B | Spiro compound and medical application thereof | 中国医药研究开发中心有限公司 | 2022-08-16 | — | — | CN | disclosed |
| EP-3904357-A1 | SPIRO COMPOUND AND MEDICAL USES THEREOF | The National Institutes of Pharmaceutical R&D Co., Ltd (CN) | 2021-11-03 | — | — | EP | disclosed |
| CN-112739705-A | Spiro compound and medical application thereof | 中国医药研究开发中心有限公司 | 2021-04-30 | — | — | CN | disclosed |