Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | CTSC | P53634 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 2/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 2/20 | 0.39 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.39 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29274341 | 0.80 | TAAR1 (0.42) | ALDH1A1HPGDHTR2ATAAR1MAOA | |
| SCHEMBL10940258 | 0.78 | EPHX1 (0.44) | SLC6A4SLC6A2SLC6A3CTSCALDH1A1 | |
| SCHEMBL7285974 | 0.75 | MAOA (0.42) | CTSCPOLBALDH1A1HPGDALOX15 | |
| SCHEMBL4323888 | 0.75 | CTSC (0.44) | SLC6A4SLC6A2SLC6A3CTSCCNR2 | |
| SCHEMBL5758862 | 0.75 | CTSC (0.48) | SLC6A4SLC6A2SLC6A3CTSCPOLB | |
| SCHEMBL13900603 | 0.75 | POLB (0.47) | CTSCPOLBALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL3997283 | 0.75 | CTSC (0.44) | SLC6A4SLC6A2SLC6A3CTSCCNR2 | |
| SCHEMBL2163440 | 0.75 | CTSC (0.44) | SLC6A4SLC6A2SLC6A3CTSCCNR2 | |
| SCHEMBL5774965 | 0.75 | CTSC (0.48) | SLC6A4SLC6A2SLC6A3CTSCPOLB | |
| SCHEMBL1261202 | 0.75 | ALDH1A1 (0.48) | CNR2ALDH1A1HPGDALOX15ALOX12 |
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 |
|---|---|---|---|---|---|---|---|
| US-3984336-A | BETA-THIO-PROPIONITRILE, ANTIWEAR AGENTS | MOBIL OIL CORPORATION (US) | 1976-10-05 | — | — | US | disclosed |