Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.44 |
| ▸ | HRH1 | P35367 | 3/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | RET | P07949 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL11456556 | 0.83 | SLC6A2 (0.42) | HTR2AHRH1HTR2CSLC6A2SLC6A4 | |
| SCHEMBL11473332 | 0.82 | PRCP (0.54) | HTR2ARETSLC6A4SLC6A3MEN1 | |
| SCHEMBL30952114 | 0.82 | PRCP (0.54) | HTR2ARETSLC6A4SLC6A3MEN1 | |
| SCHEMBL11461516 | 0.79 | PRCP (0.43) | HTR2AHRH1HTR2CRETSLC6A2 | |
| SCHEMBL13925165 | 0.79 | HTR2A (0.50) | HTR2AHRH1HTR2CSLC6A2SLC6A4 | |
| SCHEMBL4851605 | 0.76 | OPRM1 (0.41) | SLC6A2SLC6A4SLC6A3TDP1KDM4E | |
| Potassium Ion SCHEMBL4853484 | 0.74 | BLM (0.42) | SLC6A2SLC6A4SLC6A3TDP1ALDH1A1 | |
| SCHEMBL4856535 | 0.73 | CACNA1G (0.43) | KDM4EOPRM1OPRK1LMNA | |
| SCHEMBL13079294 | 0.73 | SIGMAR1 (0.42) | HTR2AHRH1HTR2CRET | |
| SCHEMBL18559580 | 0.72 | SLC6A2 (0.46) | HTR2AHRH1HTR2CSLC6A2SLC6A4 |
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-117529476-A | Preparation of substituted 1, 2-diamino heterocyclic derivatives and their use as medicaments | 亚飞络思制药公司 | 2024-02-06 | — | — | CN | disclosed |