Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | SCN1A | P35498 | 1/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL28974702 | 0.89 | LMNA (0.48) | OPRM1HRH4ACHEADRA2C | |
| O-Xylene SCHEMBL28974550 | 0.81 | TSHR (0.46) | OPRM1HRH4KMT2AMEN1ACHE | |
| SCHEMBL65054 | 0.81 | — | — | |
| SCHEMBL7004904 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL1700097 | 0.78 | GNAI3 (0.42) | KMT2ATDP1KDM4EALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL9523475 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL8080295 | 0.75 | GNAI3 (0.41) | KMT2ATDP1KDM4EALDH1A1GAA | |
| SCHEMBL81814 | 0.73 | MAPT (0.65) | KMT2AMEN1KDM4EALDH1A1GAA | |
| SCHEMBL15489560 | 0.73 | MAPT (0.65) | KMT2AMEN1KDM4EALDH1A1GAA | |
| SCHEMBL21574870 | 0.71 | GAA (0.52) | HRH4KMT2AMEN1KDM4EALDH1A1 |
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-115703750-A | Extraction and purification method of 1-amino-4-methylpiperazine | 黑龙江华瑞生物科技有限公司 | 2023-02-17 | — | — | CN | disclosed |