Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 16/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL18002732 | 0.85 | POLB (0.49) | NPC1POLBKDM4EALDH1A1MAPT | |
| SCHEMBL12999043 | 0.84 | POLB (0.52) | NPC1POLBKDM4EMEN1ALDH1A1 | |
| SCHEMBL14852240 | 0.78 | ALDH1A1 (0.56) | KDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL2883176 | 0.77 | ALDH1A1 (0.46) | NPC1POLBKDM4EMEN1ALDH1A1 | |
| SCHEMBL28944938 | 0.75 | PTPN1 (0.56) | NPC1POLBKDM4EMEN1ALDH1A1 | |
| SCHEMBL11551027 | 0.74 | MAOB (0.49) | NPC1POLBALDH1A1CYP2A6 | |
| SCHEMBL10762254 | 0.73 | MAOB (0.47) | POLBMEN1KMT2AGSK3B | |
| SCHEMBL18235043 | 0.73 | PTPN1 (0.47) | KDM4EALDH1A1CYP2A6 | |
| SCHEMBL11425123 | 0.72 | POLB (0.56) | NPC1POLBKDM4EMEN1ALDH1A1 | |
| SCHEMBL12457656 | 0.72 | CYP2A6 (0.56) | NPC1POLBKDM4EMEN1ALDH1A1 |
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-2015008872-A1 | CYANOTRIAZOLE COMPOUNDS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2015-01-22 | — | — | WO | disclosed |