Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | EEF2K | O00418 | 4/20 | 0.33 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.32 |
| ▸ | EEF2 | P13639 | 1/20 | 0.32 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.30 |
| ▸ | HIPK2 | Q9H2X6 | 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 | |
|---|---|---|---|---|
| SCHEMBL14969015 | 0.84 | KDM4E (0.39) | IKBKBKDM4EALDH1A1GLAGAA | |
| SCHEMBL14969189 | 0.81 | IKBKB (0.35) | IKBKBKDM4EALDH1A1GLAGAA | |
| SCHEMBL14968966 | 0.76 | IKBKB (0.41) | IKBKBKDM4EALDH1A1GLAGAA | |
| SCHEMBL14969048 | 0.73 | SLC1A3 (0.38) | KDM4EALDH1A1GAAHPGD | |
| SCHEMBL14969065 | 0.73 | IKBKB (0.41) | IKBKBKDM4EALDH1A1GLAGAA | |
| SCHEMBL14969297 | 0.71 | ACLY (0.36) | IKBKBALDH1A1HPGDPARP1 | |
| SCHEMBL14969324 | 0.71 | CHRM2 (0.30) | — | |
| SCHEMBL14969185 | 0.69 | RCE1 (0.38) | IKBKBKDM4EALDH1A1GLAGAA | |
| SCHEMBL14969098 | 0.68 | RCE1 (0.36) | IKBKBKDM4EALDH1A1GLAGAA | |
| SCHEMBL31692851 | 0.67 | IKBKB (0.46) | IKBKBKDM4EALDH1A1GLAGAA |
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-2013072882-A1 | 2 -AMINO- 1, 8 -NAPHTHYRIDINE-3 -CARBOXAMIDE DERIVATIVES AS ANTIMICROBIAL AGENTS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-23 | — | — | WO | disclosed |