Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.43 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.43 |
| ▸ | PLK4 | O00444 | 7/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | SI | P14410 | 1/20 | 0.38 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL30548926 | 0.76 | GSK3B (0.59) | GSK3BPDK2PDK4PLK4AURKB | |
| SCHEMBL4778699 | 0.76 | GSK3B (0.55) | GSK3BPDK2PDK4PLK4AURKB | |
| SCHEMBL2573765 | 0.76 | GSK3B (0.59) | GSK3BPDK2PDK4PLK4AURKB | |
| SCHEMBL19216470 | 0.76 | GSK3B (0.59) | GSK3BPDK2PDK4PLK4AURKB | |
| SCHEMBL31435686 | 0.72 | GSK3B (0.51) | GSK3BPDK2PDK4PLK4AURKB | |
| SCHEMBL26050871 | 0.72 | GSK3B (0.51) | GSK3BPDK2PDK4PLK4AURKB | |
| SCHEMBL3083904 | 0.71 | PDK2 (0.47) | PDK2PDK4LMNAALDH1A1MEN1 | |
| SCHEMBL23501944 | 0.71 | GSK3B (0.50) | GSK3BPDK2PDK4PLK4AURKB | |
| SCHEMBL14555908 | 0.71 | GSK3B (0.50) | GSK3BPDK2PDK4PLK4AURKB | |
| SCHEMBL2555060 | 0.71 | GSK3B (0.50) | GSK3BPDK2PDK4PLK4AURKB |
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-111704571-A | Preparation method of optically active 2-aryl spiro [ cyclopentane-1, 3' -indole ] -3-formaldehyde | 南宁师范大学 | 2020-09-25 | — | — | CN | disclosed |