Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.57 |
| ▸ | IDO1 | P14902 | 1/20 | 0.56 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | JUN | P05412 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14966882 | 0.85 | KDM4E (0.64) | KDM4EIDO1NPSR1ALDH1A1HPGD | |
| SCHEMBL14966971 | 0.82 | KDM4E (0.56) | KDM4EIDO1TBK1NPSR1ALDH1A1 | |
| SCHEMBL14967150 | 0.81 | KDM4E (0.53) | KDM4EIDO1TBK1NPSR1ALDH1A1 | |
| SCHEMBL6731339 | 0.80 | KDM4E (0.64) | KDM4EIDO1NPSR1ALDH1A1HPGD | |
| SCHEMBL14966945 | 0.79 | KDM4E (0.51) | KDM4EIDO1TBK1NPSR1ALDH1A1 | |
| SCHEMBL16969103 | 0.79 | IDO1 (0.61) | KDM4EIDO1NPSR1ALDH1A1RAB9A | |
| SCHEMBL14966810 | 0.78 | KDM4E (0.52) | KDM4EIDO1TBK1NPSR1ALDH1A1 | |
| SCHEMBL7378942 | 0.76 | ALDH1A1 (0.52) | KDM4EIDO1NPSR1ALDH1A1HPGD | |
| SCHEMBL15567052 | 0.74 | KDM4E (0.64) | KDM4EIDO1NPSR1ALDH1A1HPGD | |
| SCHEMBL2371687 | 0.73 | KDM4E (0.55) | KDM4EIDO1NPSR1ALDH1A1HPGD |
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 |