Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 3/20 | 0.49 |
| ▸ | GSK3B | P49841 | 10/20 | 0.48 |
| ▸ | CASP7 | P55210 | 2/20 | 0.43 |
| ▸ | CASP6 | P55212 | 2/20 | 0.43 |
| ▸ | CASP8 | Q14790 | 2/20 | 0.43 |
| ▸ | CASP2 | P42575 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PRKCB | P05771 | 6/20 | 0.39 |
| ▸ | PRKCA | P17252 | 6/20 | 0.39 |
| ▸ | PRKCE | Q02156 | 3/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | PRKCG | P05129 | 6/20 | 0.39 |
| ▸ | TDP2 | O95551 | 1/20 | 0.39 |
| ▸ | CASP9 | P55211 | 1/20 | 0.39 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| Tetrahydrofuran SCHEMBL28126807 | 0.90 | CASP3 (0.59) | CASP3SMN1; SMN2LMNATDP2KMT2A | |
| Phthalimide SCHEMBL10397202 | 0.84 | GSK3B (0.68) | CASP3GSK3BCASP7CASP6CASP8 | |
| Phthalimide SCHEMBL28781233 | 0.83 | GSK3B (0.60) | CASP3GSK3BCASP7CASP6CASP8 | |
| SCHEMBL29511191 | 0.74 | CASP3 (0.81) | CASP3CASP7KMT2AMEN1ALDH1A1 | |
| SCHEMBL28263 | 0.74 | CASP3 (0.81) | CASP3CASP7KMT2AMEN1ALDH1A1 | |
| Iodide SCHEMBL30725965 | 0.72 | CASP3 (0.77) | CASP3CASP7KMT2AMEN1ALDH1A1 | |
| Phthalimide SCHEMBL28372975 | 0.72 | GSK3B (0.83) | CASP3GSK3BCASP7CASP6CASP8 | |
| Water SCHEMBL9398503 | 0.72 | CASP3 (0.77) | CASP3CASP7KMT2AMEN1ALDH1A1 | |
| Hydrogen Sulfide SCHEMBL11098631 | 0.72 | CASP3 (0.77) | CASP3KMT2AMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7736926 | 0.72 | CASP3 (0.77) | CASP3CASP7KMT2AMEN1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106866588-B | A kind of synthetic method of 3 aminomethyl tetrahydrofuran | 西安凯立新材料股份有限公司 | 2018-03-02 | — | — | CN | disclosed |
| CN-106866588-A | A kind of synthetic method of 3 aminomethyl tetrahydrofuran | 西安凯立新材料股份有限公司 | 2017-06-20 | — | — | CN | disclosed |