Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1778 | 0.89 | SLC6A4 (0.57) | SLC6A4SLC6A3TP53CYP3A4ALOX15 | |
| SCHEMBL27977892 | 0.85 | SLC6A3 (0.42) | SLC6A4SLC6A3TP53CYP3A4ALOX15 | |
| SCHEMBL9765021 | 0.84 | SLC6A4 (0.64) | SLC6A4SLC6A3TP53CYP3A4ALOX15 | |
| SCHEMBL10550753 | 0.83 | SLC6A4 (0.71) | SLC6A4SLC6A3TP53CYP3A4ALOX15 | |
| Hydrochloric Acid SCHEMBL2283 | 0.82 | SLC6A4 (0.69) | SLC6A4SLC6A3TP53CYP3A4ALOX15 | |
| Hydrochloric Acid SCHEMBL2293 | 0.81 | SLC6A4 (0.59) | SLC6A4SLC6A3TP53CYP3A4ALOX15 | |
| SCHEMBL9115421 | 0.79 | CYP3A4 (0.69) | SLC6A4SLC6A3TP53CYP3A4ALOX15 | |
| Hydrochloric Acid SCHEMBL1521 | 0.77 | SLC6A4 (0.48) | SLC6A4SLC6A3SLC6A2OPRM1OPRD1 | |
| SCHEMBL2805 | 0.77 | SLC6A4 (0.43) | SLC6A4SLC6A3SLC6A2OPRM1OPRD1 | |
| Hydrochloric Acid SCHEMBL2142 | 0.76 | SLC6A3 (0.36) | SLC6A4SLC6A3TP53CYP3A4ALOX15 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1355696-A | Method to aid smoking cessation | KNOLL PHARMACEUTICAL CO (US) | 2002-06-26 | — | — | CN | disclosed |
| EP-1150672-A1 | METHOD TO AID SMOKING CESSATION | KNOLL PHARMACEUTICAL COMPANY (US) | 2001-11-07 | — | — | EP | disclosed |
| EP-1150672-A1 | METHOD TO AID SMOKING CESSATION | KNOLL PHARMACEUTICAL COMPANY (US) | 2001-11-07 | — | — | EP | disclosed |
| WO-2000043002-A1 | METHOD TO AID SMOKING CESSATION | KNOLL PHARMACEUTICAL COMPANY (US) | 2000-07-27 | — | — | WO | disclosed |
| WO-2000043002-A1 | METHOD TO AID SMOKING CESSATION | KNOLL PHARMACEUTICAL COMPANY (US) | 2000-07-27 | — | — | WO | disclosed |