Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28947251 | 1.00 | KDM4E (0.44) | KDM4EALDH1A1POLBACHEHTR4 | |
| SCHEMBL31417732 | 0.89 | KDM4E (0.44) | KDM4EALDH1A1POLBACHEHTR4 | |
| SCHEMBL23698351 | 0.84 | KDM4E (0.39) | KDM4EALDH1A1POLBGAAMAPT | |
| SCHEMBL30678550 | 0.84 | KDM4E (0.39) | KDM4EALDH1A1POLBGAAMAPT | |
| SCHEMBL31258473 | 0.83 | KDM4E (0.44) | KDM4EALDH1A1POLBACHEHTR4 | |
| SCHEMBL23698910 | 0.83 | KDM4E (0.38) | KDM4EALDH1A1POLBHPGDHSD17B10 | |
| SCHEMBL30639963 | 0.83 | KDM4E (0.44) | KDM4EALDH1A1POLBACHEHTR4 | |
| SCHEMBL19126021 | 0.82 | ALDH1A1 (0.39) | KDM4EALDH1A1HTR4GAAHPGD | |
| SCHEMBL31417692 | 0.81 | KDM4E (0.37) | KDM4EALDH1A1POLBMAPTHPGD | |
| SCHEMBL14382462 | 0.81 | KDM4E (0.43) | KDM4EALDH1A1POLBACHEHTR4 |
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-115697994-B | Fused quinazoline derivative, preparation method thereof and application thereof in medicine | 江苏恒瑞医药股份有限公司 | 2024-08-13 | — | — | CN | disclosed |