Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Phthalimide SCHEMBL28152960 | 0.90 | CASP3 (0.49) | CASP3SMN1; SMN2LMNAKMT2AALDH1A1 | |
| SCHEMBL29511191 | 0.82 | CASP3 (0.81) | CASP3KMT2AALDH1A1MEN1HSD17B10 | |
| SCHEMBL28263 | 0.82 | CASP3 (0.81) | CASP3KMT2AALDH1A1MEN1HSD17B10 | |
| Hydrochloric Acid SCHEMBL7736926 | 0.80 | CASP3 (0.77) | CASP3KMT2AALDH1A1MEN1HSD17B10 | |
| Hydrogen Sulfide SCHEMBL11098631 | 0.80 | CASP3 (0.77) | CASP3KMT2AALDH1A1MEN1TTR | |
| SCHEMBL29025703 | 0.80 | CASP3 (0.77) | CASP3KMT2AALDH1A1MEN1HSD17B10 | |
| Water SCHEMBL9398503 | 0.80 | CASP3 (0.77) | CASP3KMT2AALDH1A1MEN1HSD17B10 | |
| Hydrogen Sulfide SCHEMBL11121709 | 0.80 | CASP3 (0.77) | CASP3KMT2AALDH1A1MEN1TTR | |
| Iodide SCHEMBL30725965 | 0.80 | CASP3 (0.77) | CASP3KMT2AALDH1A1MEN1TTR | |
| SCHEMBL28114447 | 0.78 | RNASEH1 (0.50) | SMN1; SMN2LMNAKMT2AALDH1A1MEN1 |
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-106397372-B | A kind of preparation method of 3- methylamine tetrahydrofuran | 浙江捷达科技有限公司 | 2019-01-08 | — | — | CN | disclosed |
| CN-107501213-A | A kind of synthetic method of 3 amino methyl tetrahydrofuran | 中国科学院兰州化学物理研究所 | 2017-12-22 | — | — | CN | disclosed |
| CN-106397372-A | 3-methylamine tetrahydrofuran preparation method | 浙江捷达科技有限公司 | 2017-02-15 | — | — | CN | disclosed |