Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | HTR2B | P41595 | 2/20 | 0.44 |
| ▸ | KMO | O15229 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.43 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3790814 | 0.98 | SLC6A3 (0.50) | SLC6A3SLC6A2HDAC4HDAC2HDAC8 | |
| SCHEMBL3786501 | 0.94 | HDAC4 (0.52) | SLC6A3SLC6A2HDAC4HDAC2HDAC8 | |
| SCHEMBL3783699 | 0.92 | KMO (0.53) | SLC6A3SLC6A2HDAC4HDAC2HDAC8 | |
| SCHEMBL1067433 | 0.89 | SLC6A3 (0.53) | SLC6A3SLC6A2ADRA1ASLC6A4HTR2A | |
| SCHEMBL29940424 | 0.89 | SLC6A3 (0.53) | SLC6A3SLC6A2ADRA1ASLC6A4HTR2A | |
| SCHEMBL4067327 | 0.82 | SLC6A3 (0.47) | SLC6A3SLC6A2ADRA1ASLC6A4HTR2A | |
| SCHEMBL31547364 | 0.81 | KMO (0.47) | SLC6A3SLC6A2HDAC4HDAC2HDAC8 | |
| SCHEMBL9781187 | 0.81 | HTR2A (0.55) | SLC6A3SLC6A2SLC6A4HTR2AHTR2C | |
| SCHEMBL24282695 | 0.81 | ESR2 (0.53) | SLC6A3SLC6A2HDAC4HDAC2HDAC8 | |
| SCHEMBL16233611 | 0.80 | SLC6A2 (0.46) | SLC6A3SLC6A2ADRA1ASLC6A4HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0655057-B1 | CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS | UPJOHN CO (US) | 1997-09-17 | — | — | EP | disclosed |
| US-5567722-A | DIURETICS | THE UPJOHN COMPANY (US) | 1996-10-22 | — | — | US | disclosed |
| EP-0655057-A1 | CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS. | UPJOHN CO (US) | 1995-05-31 | — | — | EP | disclosed |
| WO-1994004500-A1 | CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS | THE UPJOHN COMPANY (US) | 1994-03-03 | — | — | WO | disclosed |