Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 4/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.39 |
| ▸ | SCN1A | P35498 | 2/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | NQO1 | P15559 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8018546 | 0.88 | TYR (0.43) | SLC6A2SLC6A4CHRM2SCN1ASCN2A | |
| SCHEMBL8018556 | 0.84 | SLC6A2 (0.43) | SLC6A2SLC6A4CHRM2SCN1ASCN2A | |
| SCHEMBL8028205 | 0.75 | SLC6A2 (0.43) | SLC6A2SLC6A4CHRM2SCN1ASCN2A | |
| SCHEMBL4660881 | 0.70 | TYR (0.49) | TSHR | |
| SCHEMBL6295565 | 0.70 | TYR (0.39) | NQO1ALDH1A1AHRLMNAKDM4E | |
| SCHEMBL8797881 | 0.69 | TSHR (0.50) | SLC6A2SLC6A4CHRM2SCN1ASCN2A | |
| SCHEMBL8034147 | 0.69 | SMN1; SMN2 (0.47) | TSHRALDH1A1LMNAKDM4ERAB9A | |
| SCHEMBL7084236 | 0.68 | SLC6A2 (0.53) | SLC6A2SLC6A4CHRM2SCN1ASCN2A | |
| SCHEMBL31374423 | 0.68 | CHRM2 (0.69) | SLC6A2SLC6A4CHRM2SCN1ASCN2A | |
| SCHEMBL12475663 | 0.68 | TYR (0.58) | SLC6A2SLC6A4SLC6A3NQO1AHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000073269-A2 | NICOTINE RECEPTOR LIGANDS | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2000-12-07 | — | — | WO | disclosed |