Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 2/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | GLS | O94925 | 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 | |
|---|---|---|---|---|
| SCHEMBL30728578 | 0.81 | POLB (0.48) | CA9CA12TDP1CASP3ALDH1A1 | |
| SCHEMBL441353 | 0.81 | POLB (0.48) | CA9CA12TDP1CASP3ALDH1A1 | |
| SCHEMBL11119821 | 0.79 | POLB (0.46) | CA9CA12CASP3ALDH1A1GAA | |
| SCHEMBL29842458 | 0.69 | CA12 (0.51) | DRD3CA9CA12CASP3ALDH1A1 | |
| SCHEMBL1357288 | 0.69 | CA12 (0.51) | DRD3CA9CA12CASP3ALDH1A1 | |
| SCHEMBL8503141 | 0.69 | TDP1 (0.61) | DRD3TDP1PDE4APDE4BPDE4C | |
| Propionitrile SCHEMBL2881847 | 0.69 | ALDH1A1 (0.47) | TDP1ALDH1A1GAARAB9AGLA | |
| Water SCHEMBL3507216 | 0.69 | CYP1B1 (0.64) | DRD3CA9CA12ALDH1A1MEN1 | |
| Toluene SCHEMBL9712043 | 0.68 | TSHR (0.58) | TDP1ALDH1A1MEN1RAB9AKMT2A | |
| Propionitrile SCHEMBL8598615 | 0.67 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0723973-B1 | Nucleoside phosphorothioate derivatives, synthesis and use thereof | KING S COLLEGE LONDON (GB) | 1998-10-21 | — | — | EP | claimed |
| US-5708161-A | Nucleoside phosphorothioate derivatives, synthesis and use thereof | KING'S COLLEGE LONDON (GB) | 1998-01-13 | — | — | US | claimed |
| EP-0723973-A1 | Nucleoside phosphorothioate derivatives, synthesis and use thereof | KING'S COLLEGE LONDON (GB) | 1996-07-31 | — | — | EP | claimed |
| EP-0723973-B1 | Nucleoside phosphorothioate derivatives, synthesis and use thereof | KING S COLLEGE LONDON (GB) | 1998-10-21 | — | — | EP | disclosed |
| US-5708161-A | Nucleoside phosphorothioate derivatives, synthesis and use thereof | KING'S COLLEGE LONDON (GB) | 1998-01-13 | — | — | US | disclosed |
| EP-0723973-A1 | Nucleoside phosphorothioate derivatives, synthesis and use thereof | KING'S COLLEGE LONDON (GB) | 1996-07-31 | — | — | EP | disclosed |