Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 15/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 12/20 | 0.58 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.58 |
| ▸ | TACR1 | P25103 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11089310 | 0.88 | SLC6A3 (0.68) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL11092197 | 0.84 | SLC6A3 (0.72) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL11111638 | 0.84 | SLC6A3 (0.72) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL20139685 | 0.83 | SLC6A3 (0.59) | SLC6A3SLC6A2SLC6A4TACR1KCNH2 | |
| SCHEMBL20139580 | 0.83 | SLC6A3 (0.59) | SLC6A3SLC6A2SLC6A4TACR1KCNH2 | |
| SCHEMBL11091014 | 0.80 | SLC6A3 (0.54) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL11092947 | 0.78 | PDE4A (0.52) | SLC6A3SLC6A2SLC6A4TACR1KCNH2 | |
| SCHEMBL20576984 | 0.75 | SLC6A3 (0.42) | SLC6A3SLC6A2SLC6A4TACR1KCNH2 | |
| SCHEMBL28199057 | 0.75 | SLC6A3 (0.42) | SLC6A3SLC6A2SLC6A4TACR1KCNH2 | |
| SCHEMBL28254655 | 0.74 | SLC6A3 (0.41) | SLC6A3SLC6A2SLC6A4TACR1KCNH2 |
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-4443616-A | Production of 3-pyrrolin-2-ones | THE PURDUE FREDERICK COMPANY (US) | 1984-04-17 | — | — | US | disclosed |