Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.43 |
| ▸ | F10 | P00742 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8535949 | 0.96 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3HRH3FAAH | |
| SCHEMBL8537719 | 0.94 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3HRH3FAAH | |
| SCHEMBL8542233 | 0.94 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3HRH3FAAH | |
| SCHEMBL8535454 | 0.92 | KDM4E (0.50) | SLC6A2SLC6A4SLC6A3HRH3KCNH2 | |
| SCHEMBL8539056 | 0.92 | KDM4E (0.50) | SLC6A2SLC6A4SLC6A3HRH3KCNH2 | |
| SCHEMBL8539105 | 0.90 | KCNJ1 (0.51) | SLC6A2SLC6A4SLC6A3KCNJ1KCNH2 | |
| SCHEMBL8540476 | 0.90 | KCNJ1 (0.51) | SLC6A2SLC6A4SLC6A3KCNJ1KCNH2 | |
| SCHEMBL8588892 | 0.90 | RORC (0.48) | SLC6A2SLC6A4SLC6A3HRH3FAAH | |
| SCHEMBL8535362 | 0.81 | KDM4E (0.60) | SLC6A2SLC6A4FAAHDRD4KCNH2 | |
| SCHEMBL8539540 | 0.79 | MEN1 (0.53) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5817489-A | BACTERICIDES, OR CHEMICAL INTERMEDIATES THEREOF; DRUG LIBRARIES | ISIS PHARMACEUTICALS, INC. (US) | 1998-10-06 | — | — | US | claimed |