Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.38 |
| ▸ | PPID | Q08752 | 1/20 | 0.37 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | PTPRB | P23467 | 1/20 | 0.37 |
| ▸ | ACP1 | P24666 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7942748 | 0.92 | ALDH1A1 (0.55) | MMP8ALDH1A1RECQLPIN1SMN1; SMN2 | |
| SCHEMBL28796267 | 0.88 | ALDH1A1 (0.49) | MMP8ALDH1A1RECQLPIN1SMN1; SMN2 | |
| SCHEMBL28796243 | 0.87 | ALDH1A1 (0.48) | MMP8ALDH1A1RECQLPIN1KMT2A | |
| SCHEMBL28796264 | 0.87 | ALDH1A1 (0.48) | MMP8ALDH1A1RECQLPIN1LMNA | |
| SCHEMBL28796256 | 0.86 | ALDH1A1 (0.47) | MMP8ALDH1A1RECQLLMNANPSR1 | |
| SCHEMBL28796335 | 0.83 | AR (0.44) | MMP8ALDH1A1RECQLSMN1; SMN2LMNA | |
| SCHEMBL29048912 | 0.80 | MMP8 (0.46) | MMP8ALDH1A1RECQLPIN1SMN1; SMN2 | |
| SCHEMBL29277135 | 0.79 | ALDH1A1 (0.54) | MMP8ALDH1A1RECQLPIN1SMN1; SMN2 | |
| SCHEMBL28296480 | 0.77 | MMP8 (0.44) | MMP8ALDH1A1RECQLPIN1SMN1; SMN2 | |
| SCHEMBL28296727 | 0.77 | CCR1 (0.43) | MMP8ALDH1A1RECQLCYP1A2L3MBTL1 |
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-109694334-B | Solvent-free preparation method of disubstituted cyanoacetate compound | 西华大学 | 2022-07-22 | — | — | CN | disclosed |