Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.33 |
| ▸ | PPM1B | O75688 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7189528 | 0.89 | MAPT (0.42) | MAPTPKMKDM4ECYP1A2CYP2D6 | |
| SCHEMBL1417951 | 0.89 | MAPT (0.42) | MAPTPKMKDM4ECYP1A2CYP2D6 | |
| SCHEMBL27550910 | 0.89 | MAPT (0.42) | MAPTPKMKDM4ECYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL2920606 | 0.87 | MAPT (0.44) | MAPTPKMKDM4ECYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL4283062 | 0.87 | MAPT (0.44) | MAPTPKMKDM4ECYP1A2CYP2D6 | |
| Azetidine SCHEMBL18917062 | 0.86 | PRCP (0.43) | MAPTPKMSLC6A2SLC6A3SLC6A4 | |
| Acetic Acid SCHEMBL6729875 | 0.84 | MAPT (0.43) | MAPTPKMKDM4ECYP1A2CYP2D6 | |
| SCHEMBL115996 | 0.81 | PRCP (0.45) | SLC6A2SLC6A3SLC6A4ALDH1A1PPM1B | |
| SCHEMBL10829027 | 0.81 | PRCP (0.45) | SLC6A2SLC6A3SLC6A4ALDH1A1PPM1B | |
| SCHEMBL3330660 | 0.81 | PRCP (0.45) | SLC6A2SLC6A3SLC6A4ALDH1A1PPM1B |
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-1774435-A | 5-membered heterocyclic derivative | DAIICHI SEIYAKU CO (JP) | 2006-05-17 | — | — | CN | disclosed |
| CN-1759110-A | Pyrazole derivatives | DAIICHI SEIYAKU CO (JP) | 2006-04-12 | — | — | CN | disclosed |