Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.44 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.44 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | PRKDC | P78527 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29913321 | 0.86 | AKR1C3 (0.61) | GAASMN1; SMN2MAPTAKR1C3TP53 | |
| SCHEMBL723657 | 0.86 | AKR1C3 (0.61) | GAASMN1; SMN2MAPTAKR1C3TP53 | |
| Benzophenone SCHEMBL27290721 | 0.82 | ALDH1A1 (0.64) | GAASMN1; SMN2MAPTTP53ALDH1A1 | |
| Benzophenone SCHEMBL9305504 | 0.82 | ALDH1A1 (0.64) | GAASMN1; SMN2MAPTTP53ALDH1A1 | |
| Benzophenone SCHEMBL9306545 | 0.80 | ALDH1A1 (0.61) | GAASMN1; SMN2MAPTTP53ALDH1A1 | |
| Benzophenone SCHEMBL8559670 | 0.80 | ALDH1A1 (0.61) | GAASMN1; SMN2MAPTTP53ALDH1A1 | |
| Benzophenone SCHEMBL28179600 | 0.80 | ALDH1A1 (0.61) | GAASMN1; SMN2MAPTTP53ALDH1A1 | |
| SCHEMBL3839155 | 0.78 | MAPK13 (0.58) | GAAMAPTAKR1C3TP53ALDH1A1 | |
| Aniline SCHEMBL28546981 | 0.77 | MAPT (0.58) | GAASMN1; SMN2MAPTAKR1C3TP53 | |
| Acetaldehyde SCHEMBL27703524 | 0.77 | AKR1C3 (0.52) | GAASMN1; SMN2MAPTAKR1C3TP53 |
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-110128316-B | Preparation method of 5-substituted beta-proline and derivatives thereof | PEKING UNIVERSITY SHENZHEN GRADUATE SCHOOL (CN) | 2021-08-31 | — | — | CN | disclosed |
| CN-110128316-A | The preparation method of 5 β-proline replaced and its derivative | 北京大学深圳研究生院 | 2019-08-16 | — | — | CN | disclosed |