Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.37 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | NPM1 | P06748 | 2/20 | 0.36 |
| ▸ | ALK | Q9UM73 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14247504 | 0.84 | HCAR1 (0.49) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL14247592 | 0.84 | HCAR1 (0.47) | ALDH1A1KDM4EMEN1KMT2AMAPT | |
| SCHEMBL23652406 | 0.82 | KDM4E (0.55) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL31144716 | 0.78 | ALDH1A1 (0.52) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL14247826 | 0.77 | DHFR (0.46) | LMNAMAPTHTTMAPK1SMN1; SMN2 | |
| SCHEMBL11143618 | 0.77 | KMT2A (0.39) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL14247198 | 0.76 | KMT2A (0.51) | ALDH1A1KDM4EMEN1KMT2AHPGD | |
| SCHEMBL14247635 | 0.74 | MEN1 (0.53) | MEN1KMT2AADORA2AADORA1MAPK14 | |
| SCHEMBL31497543 | 0.74 | ADORA2B (0.37) | ALDH1A1MEN1KMT2AMAPTHTT | |
| SCHEMBL17583064 | 0.74 | BACE1 (0.38) | ALDH1A1KMT2AMAPTHTTMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012174312-A2 | BENZIMIDAZOLE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-12-20 | — | — | WO | disclosed |
| WO-2012174312-A2 | BENZIMIDAZOLE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-12-20 | — | — | WO | disclosed |