Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 3/20 | 0.38 |
| ▸ | PDE9A | O76083 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL5774512 | 0.88 | ALDH1A1 (0.40) | KDM4EALDH1A1GAACYP2C19MAPK14 | |
| SCHEMBL5773725 | 0.85 | MAPK14 (0.42) | KDM4EALDH1A1GAACYP1A2CYP3A4 | |
| SCHEMBL5773723 | 0.83 | MAPK14 (0.41) | KDM4EALDH1A1GAACYP1A2CYP3A4 | |
| SCHEMBL5770367 | 0.80 | MAPK14 (0.41) | GAACYP3A4CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL5770827 | 0.80 | TP53 (0.48) | ALDH1A1GAACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5767550 | 0.77 | MAPK14 (0.38) | CYP3A4MAPK14 | |
| SCHEMBL5769574 | 0.77 | PI4KB (0.36) | CYP3A4MAPK14 | |
| SCHEMBL18058953 | 0.74 | THRB (0.50) | KDM4EALDH1A1GAACYP1A2CYP3A4 | |
| SCHEMBL5772161 | 0.74 | PI4KB (0.39) | KDM4EALDH1A1CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL18057139 | 0.74 | MAPK14 (0.44) | ALDH1A1GAACYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1554272-B1 | BENZIMIDAZOLES AND BENZOTHIAZOLES AS INHIBITORS OF MAP KINASE | LILLY CO ELI (US) | 2006-10-25 | — | — | EP | disclosed |