Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | USP5 | P45974 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28540543 | 0.89 | MMP2 (0.40) | MAPTMMP2ALDH1A1HTTACHE | |
| SCHEMBL28541517 | 0.88 | MMP2 (0.47) | MMP2ALDH1A1HTTACHESMN1; SMN2 | |
| SCHEMBL28542268 | 0.87 | MAPT (0.47) | MAPTALDH1A1HTTACHELMNA | |
| SCHEMBL28540365 | 0.82 | MAPT (0.46) | MAPTMMP2ALDH1A1HTTACHE | |
| SCHEMBL28541495 | 0.82 | ALDH1A1 (0.40) | MAPTALDH1A1HTTACHESMN1; SMN2 | |
| SCHEMBL28540550 | 0.81 | ALDH1A1 (0.39) | MAPTMMP2ALDH1A1HTTACHE | |
| SCHEMBL28551010 | 0.80 | HSD11B1 (0.50) | ALDH1A1LMNA | |
| SCHEMBL28532121 | 0.79 | NPSR1 (0.51) | MAPTMMP2ALDH1A1LMNARAB9A | |
| SCHEMBL28547908 | 0.78 | ALDH1A1 (0.39) | MAPTMMP2ALDH1A1HTTACHE | |
| SCHEMBL1792211 | 0.77 | ALDH1A1 (0.50) | MAPTMMP2ALDH1A1CYP2D6HTT |
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-112608269-B | Method for catalytically synthesizing pyrrolidine by weak interaction of chalcogen | 山东大学 | 2022-05-06 | — | — | CN | disclosed |
| CN-112608269-A | Method for catalytically synthesizing pyrrolidine by weak interaction of chalcogen | 山东大学 | 2021-04-06 | — | — | CN | disclosed |