Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | EEF2K | O00418 | 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 | |
|---|---|---|---|---|
| SCHEMBL14969018 | 0.85 | IKBKB (0.39) | IKBKBGAAKDM4EALDH1A1GLA | |
| SCHEMBL14968923 | 0.81 | IKBKB (0.38) | IKBKBGAAKDM4EALDH1A1GLA | |
| SCHEMBL14968867 | 0.77 | IKBKB (0.39) | IKBKBGAAKDM4EALDH1A1GLA | |
| SCHEMBL14969065 | 0.77 | IKBKB (0.41) | IKBKBGAAKDM4EALDH1A1GLA | |
| SCHEMBL14966609 | 0.77 | IKBKB (0.41) | IKBKBGAAKDM4EALDH1A1GLA | |
| SCHEMBL14969017 | 0.72 | IKBKB (0.38) | IKBKBGAAKDM4EALDH1A1GLA | |
| SCHEMBL14966945 | 0.72 | KDM4E (0.51) | GAAKDM4EALDH1A1HPGDNPSR1 | |
| SCHEMBL14969252 | 0.70 | EEF2K (0.34) | IKBKBGAAKDM4EALDH1A1GLA | |
| SCHEMBL14969228 | 0.70 | GAA (0.33) | IKBKBGAAEEF2K | |
| SCHEMBL14969004 | 0.67 | IKBKB (0.36) | IKBKBGAAKDM4EALDH1A1GLA |
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 |