Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 5/20 | 0.76 |
| ▸ | LMNA | P02545 | 6/20 | 0.68 |
| ▸ | HTT | P42858 | 3/20 | 0.68 |
| ▸ | MAPT | P10636 | 3/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.66 |
| ▸ | TSHR | P16473 | 4/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
| ▸ | TCF4 | P15884 | 1/20 | 0.61 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | FLT1 | P17948 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL16119560 | 1.00 | CYP2C9 (0.76) | CYP2C9LMNAHTTMAPTKDM4E | |
| SCHEMBL7573928 | 0.88 | CYP2C9 (0.82) | CYP2C9LMNAHTTMAPTKDM4E | |
| SCHEMBL21222732 | 0.86 | LMNA (0.73) | CYP2C9LMNAHTTMAPTKDM4E | |
| SCHEMBL1073233 | 0.86 | CYP2C9 (1.00) | CYP2C9LMNAHTTMAPTKDM4E | |
| SCHEMBL16318203 | 0.85 | KDM4E (0.61) | CYP2C9LMNAHTTMAPTKDM4E | |
| SCHEMBL24102911 | 0.84 | CYP2C9 (0.76) | CYP2C9LMNAHTTMAPTKDM4E | |
| SCHEMBL22391857 | 0.84 | CYP2C9 (0.76) | CYP2C9LMNAHTTMAPTKDM4E | |
| SCHEMBL28560173 | 0.84 | CYP2C9 (0.80) | CYP2C9LMNAHTTKDM4ETSHR | |
| SCHEMBL12787927 | 0.82 | CYP2C9 (0.81) | CYP2C9LMNAKDM4ETSHRSMN1; SMN2 | |
| SCHEMBL16438047 | 0.81 | MAPT (0.64) | CYP2C9LMNAHTTMAPTALDH1A1 |
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-111285806-B | Pyrazole compound and preparation method, application and pharmaceutical composition thereof | 中国医学科学院药物研究所 | 2022-04-15 | — | — | CN | disclosed |