Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.47 |
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12996843 | 1.00 | SLC6A3 (0.47) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL10326440 | 0.98 | SLC6A3 (0.47) | SLC6A3SLC6A2SLC6A4DHFR | |
| SCHEMBL10326717 | 0.98 | SLC6A3 (0.47) | SLC6A3SLC6A2SLC6A4DHFR | |
| SCHEMBL10326261 | 0.98 | SLC6A3 (0.47) | SLC6A3SLC6A2SLC6A4DHFR | |
| SCHEMBL10326624 | 0.93 | SLC6A3 (0.54) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL10327324 | 0.93 | SLC6A3 (0.54) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL10326911 | 0.93 | SLC6A3 (0.54) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL670331 | 0.91 | SLC6A3 (0.53) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL2844473 | 0.91 | SLC6A3 (0.53) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL2842321 | 0.91 | SLC6A3 (0.53) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012074075-A1 | METHOD FOR MANUFACTURING OPTICALLY ACTIVE MENTHOL | 高砂香料工業株式会社 (JP) | 2012-06-07 | — | — | WO | disclosed |
| WO-2011108672-A2 | HOMOGENEOUS ASYMMETRIC HYDROGENATION CATALYST | 高砂香料工業株式会社 (JP) | 2011-09-09 | — | — | WO | disclosed |