Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4747654 | 0.84 | HDAC1 (0.46) | ALDH1A1SMN1; SMN2RAB9ANPC1HDAC1 | |
| SCHEMBL9824905 | 0.83 | POLB (0.51) | ALDH1A1SMN1; SMN2RAB9ANPC1POLB | |
| SCHEMBL5457229 | 0.73 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2HTTTDP1L3MBTL1 | |
| SCHEMBL3919646 | 0.72 | SMN1; SMN2 (0.49) | ALDH1A1SMN1; SMN2RAB9ANPC1POLB | |
| SCHEMBL7163959 | 0.72 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2HTTTDP1L3MBTL1 | |
| SCHEMBL7443478 | 0.70 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2HTTTDP1L3MBTL1 | |
| SCHEMBL17866316 | 0.69 | HDAC1 (0.49) | ALDH1A1POLBTDP1L3MBTL1HDAC1 | |
| SCHEMBL19281553 | 0.69 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2RAB9ANPC1POLB | |
| SCHEMBL465595 | 0.68 | ALDH1A1 (0.63) | ALDH1A1POLBTDP1L3MBTL1HPGD | |
| SCHEMBL7417079 | 0.68 | SMN1; SMN2 (0.47) | ALDH1A1SMN1; SMN2RAB9ANPC1POLB |
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-2008107677-A2 | THIADIAZOLE AND OXADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS | SENEXIS LIMITED (GB) | 2008-09-12 | — | — | WO | disclosed |