Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | GHSR | Q92847 | 3/20 | 0.45 |
| ▸ | OGG1 | O15527 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11675606 | 0.93 | OGG1 (0.44) | SLC6A4GHSROGG1ALDH1A1MAPT | |
| SCHEMBL11677924 | 0.91 | GHSR (0.44) | SLC6A4GHSROGG1ALDH1A1MAPT | |
| SCHEMBL11676850 | 0.87 | TAAR1 (0.43) | GHSROGG1 | |
| SCHEMBL11677657 | 0.87 | OGG1 (0.41) | SLC6A4GHSROGG1ALDH1A1MAPT | |
| SCHEMBL11676736 | 0.86 | KDM4E (0.43) | SLC6A4GHSROGG1ALDH1A1MAPT | |
| SCHEMBL11670757 | 0.85 | GHSR (0.41) | GHSROGG1ALDH1A1MAPTKDM4E | |
| SCHEMBL11676339 | 0.85 | S1PR1 (0.41) | GHSROGG1ALDH1A1MAPT | |
| SCHEMBL8057970 | 0.84 | MAPT (0.38) | SLC6A4ALDH1A1MAPTKDM4E | |
| SCHEMBL11676457 | 0.84 | MAPT (0.41) | MAPT | |
| SCHEMBL11677133 | 0.84 | MAOA (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4051084-A | BENZOTHIAZOLE | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-27 | — | — | US | disclosed |
| US-4051117-A | Triazole-azo-phenyl cationic dyestuffs | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-27 | — | — | US | disclosed |