Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.57 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.57 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | SCN1A | P35498 | 1/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.44 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.38 |
| ▸ | KCNE1 | P15382 | 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 | |
|---|---|---|---|---|
| SCHEMBL29029215 | 1.00 | SLC6A2 (0.57) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| Hydrochloric Acid SCHEMBL28453921 | 0.98 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| Ammonia Solution, Strong SCHEMBL6000289 | 0.98 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| SCHEMBL28711798 | 0.89 | SLC6A2 (0.44) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| SCHEMBL1515754 | 0.81 | SLC6A2 (0.57) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| SCHEMBL6160196 | 0.79 | SLC6A2 (0.48) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| SCHEMBL17858535 | 0.78 | DYRK1A (0.42) | SLC6A2SLC6A4SLC6A3ALDH1A1RAB9A | |
| SCHEMBL7640862 | 0.78 | KDM4E (0.39) | SLC6A2SLC6A4SLC6A3ALDH1A1KDM4E | |
| SCHEMBL11215459 | 0.77 | SLC6A2 (0.52) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A | |
| SCHEMBL11215460 | 0.77 | SLC6A2 (0.52) | SLC6A2SLC6A4SLC6A3CHRM2SCN1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116396211-A | Method for preparing meta-chiral allyl substituted pyridine compound | 南开大学 | 2023-07-07 | — | — | CN | disclosed |
| US-4816454-A | CARDIOVASCULAR DISORDERS | CASSELLA AKTIENGESELLSCHAFT (DE) | 1989-03-28 | — | — | US | disclosed |
| EP-0175363-A2 | 4,5-Dihydro-3(2H)-pyridazinones, process for their preparation and their use | CASSELLA Aktiengesellschaft (DE) | 1986-03-26 | — | — | EP | disclosed |
| EP-0069521-A2 | Pyridinyl and imidazolyl derivatives of benzofurans and benzothiophenes | THE UPJOHN COMPANY (US) | 1983-01-12 | — | — | EP | disclosed |