Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2873804 | 0.88 | AAK1 (0.34) | KDM4EALDH1A1GAAMAPTHPGD | |
| SCHEMBL2868954 | 0.72 | SMN1; SMN2 (0.36) | KDM4EALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL2866147 | 0.72 | AAK1 (0.38) | RAB9ASMN1; SMN2AAK1NPC1POLB | |
| SCHEMBL6753981 | 0.67 | AAK1 (0.45) | ALDH1A1RAB9ASMN1; SMN2AAK1NPC1 | |
| SCHEMBL2872949 | 0.67 | KDM4E (0.36) | KDM4EALDH1A1GAAMAPTHPGD | |
| SCHEMBL2430568 | 0.66 | GAA (0.41) | KDM4EALDH1A1GAAMAPTHPGD | |
| SCHEMBL28193295 | 0.66 | CCNB2 (0.33) | KDM4EALDH1A1MAPTHTT | |
| SCHEMBL2870191 | 0.66 | PTGES (0.31) | — | |
| SCHEMBL17675675 | 0.66 | TBK1 (0.32) | XDH | |
| SCHEMBL2873807 | 0.66 | AAK1 (0.35) | MAPTSMN1; SMN2HTTAAK1 |
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-2010103306-A1 | BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS ANTIVARAL AGENTS | ASTRAZENECA UK LIMITED (GB) | 2010-09-16 | — | — | WO | disclosed |