Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 9/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.38 |
| ▸ | CYP8B1 | Q9UNU6 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21381370 | 0.88 | SYK (0.40) | SYKKDRCHRM4HDAC11CYP8B1 | |
| SCHEMBL21384608 | 0.82 | KDR (0.54) | KDR | |
| Hydrochloric Acid SCHEMBL6158505 | 0.76 | NUDT1 (0.54) | CHRM4 | |
| SCHEMBL21381376 | 0.74 | KDR (0.45) | SYKKDRHDAC11 | |
| SCHEMBL5299350 | 0.74 | PDGFRB (0.48) | SYKKDRHDAC11 | |
| SCHEMBL4445915 | 0.72 | KDR (0.68) | KDRALDH1A1 | |
| SCHEMBL22492342 | 0.72 | PLA2G2A (0.54) | PLA2G2A | |
| SCHEMBL19230796 | 0.72 | DRD2 (0.42) | SYKKDRHDAC11ALDH1A1 | |
| SCHEMBL19230794 | 0.71 | MAPT (0.42) | SYKKDRHDAC11ALDH1A1 | |
| SCHEMBL20935296 | 0.70 | CHRM4 (0.52) | CHRM4CYP8B1PIK3CA |
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-111630043-B | Compound containing ring, preparation method and application thereof in medicine | 四川科伦博泰生物医药股份有限公司 | 2022-02-15 | — | — | CN | disclosed |
| CN-111630043-A | Compound containing ring, preparation method and application thereof in medicine | 四川科伦博泰生物医药股份有限公司 | 2020-09-04 | — | — | CN | disclosed |
| WO-2019179369-A1 | RING-CONTAINING COMPOUND, PREPARATION METHOD THEREFOR, AND MEDICAL APPLICATION THEREOF | 四川科伦博泰生物医药股份有限公司 | 2019-09-26 | — | — | WO | disclosed |