Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A1 | P30531 | 13/20 | 1.00 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.73 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.73 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.73 |
| ▸ | TSHR | P16473 | 1/20 | 0.73 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.73 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.73 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.73 |
| ▸ | LMNA | P02545 | 1/20 | 0.73 |
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 | |
|---|---|---|---|---|
| SCHEMBL8820163 | 0.90 | SLC6A1 (0.81) | SLC6A1CYP1A2CYP2D6CYP2C9TSHR | |
| SCHEMBL8820157 | 0.90 | SLC6A1 (0.81) | SLC6A1CYP1A2CYP2D6CYP2C9TSHR | |
| SCHEMBL9526327 | 0.90 | SLC6A1 (0.87) | SLC6A1CYP1A2CYP2D6CYP2C9TSHR | |
| SCHEMBL9526330 | 0.90 | SLC6A1 (0.87) | SLC6A1CYP1A2CYP2D6CYP2C9TSHR | |
| SCHEMBL9525512 | 0.89 | SLC6A1 (0.83) | SLC6A1 | |
| SCHEMBL9526548 | 0.89 | SLC6A1 (0.83) | SLC6A1 | |
| Hydrochloric Acid SCHEMBL10407201 | 0.89 | SLC6A1 (0.80) | SLC6A1CYP1A2CYP2D6CYP2C9TSHR | |
| SCHEMBL10406661 | 0.89 | SLC6A1 (0.80) | SLC6A1CYP1A2CYP2D6CYP2C9TSHR | |
| SCHEMBL9525515 | 0.89 | SLC6A1 (0.83) | SLC6A1 | |
| SCHEMBL10406662 | 0.89 | SLC6A1 (0.80) | SLC6A1CYP1A2CYP2D6CYP2C9TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1199637-C | Use of GABA transport protein inhibitor in preparing medicine for treating alcohol habituation and abuse | SHANGHAI INST OF LIFE SCI CHIN (CN) | 2005-05-04 | — | — | CN | disclosed |
| CN-1401319-A | Use of GABA transport protein inhibitor in preparing medicine for treating alcohol habituation and abuse | SHANGHAI INST OF LIFE SCI CHIN (CN) | 2003-03-12 | — | — | CN | disclosed |
| CN-1382441-A | Application of gammalon transporter inhibitor in preparing analgesic | SHANGHAI INST OF LIFE SCIENCES (CN) | 2002-12-04 | — | — | CN | disclosed |