Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | ICMT | O60725 | 1/20 | 0.34 |
| ▸ | PRKCI | P41743 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.31 |
| ▸ | TTR | P02766 | 1/20 | 0.31 |
| ▸ | ALB | P02768 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.31 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29278111 | 1.00 | HRH3 (0.36) | HRH3ICMTPRKCISLC6A4SLC6A2 | |
| SCHEMBL29278120 | 0.86 | MPO (0.38) | HRH3ICMTPRKCISLC6A4TSHR | |
| SCHEMBL30762191 | 0.86 | MPO (0.38) | HRH3ICMTPRKCISLC6A4TSHR | |
| SCHEMBL30762166 | 0.84 | TSHR (0.45) | HRH3ICMTPRKCISLC6A4SLC6A2 | |
| SCHEMBL29278118 | 0.84 | SLC6A4 (0.38) | HRH3ICMTPRKCISLC6A4SLC6A2 | |
| SCHEMBL29278114 | 0.84 | TSHR (0.45) | HRH3ICMTPRKCISLC6A4SLC6A2 | |
| SCHEMBL30762171 | 0.84 | SLC6A4 (0.38) | HRH3ICMTPRKCISLC6A4SLC6A2 | |
| SCHEMBL17672896 | 0.77 | HRH3 (0.43) | HRH3ICMTSLC6A4SLC6A2SLC6A3 | |
| SCHEMBL29278097 | 0.76 | LOXL2 (0.48) | HRH3CYP2A6LOXL2 | |
| SCHEMBL11617787 | 0.74 | PRKCI (0.46) | HRH3ICMTPRKCISLC6A4SLC6A2 |
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-117402081-A | Aryl substituted amine derivative, preparation method and application thereof | 南京医科大学 | 2024-01-16 | — | — | CN | disclosed |