Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CD38 | P28907 | 2/20 | 0.33 |
| ▸ | EEF2K | O00418 | 1/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.31 |
| ▸ | CDK2 | P24941 | 2/20 | 0.31 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | IKBKB | O14920 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL14969029 | 0.94 | LRRK2 (0.33) | KDM4EALDH1A1LMNAHPGDTSHR | |
| SCHEMBL14969228 | 0.85 | GAA (0.33) | CD38EEF2KIDO1IKBKB | |
| SCHEMBL14969047 | 0.81 | EEF2K (0.34) | EEF2KIDO1IKBKB | |
| SCHEMBL14969144 | 0.81 | EEF2K (0.35) | KDM4EALDH1A1HPGDEEF2KIDO1 | |
| SCHEMBL14969004 | 0.80 | IKBKB (0.36) | KDM4EALDH1A1HPGDEEF2KIDO1 | |
| SCHEMBL14969024 | 0.79 | RCE1 (0.36) | KDM4EALDH1A1HPGDCD38EEF2K | |
| SCHEMBL14968982 | 0.78 | IDO1 (0.33) | KDM4EALDH1A1HPGDEEF2KIDO1 | |
| SCHEMBL14968912 | 0.78 | RCE1 (0.38) | KDM4EALDH1A1HPGDCD38EEF2K | |
| SCHEMBL14969095 | 0.78 | ENPP1 (0.40) | KDM4EALDH1A1HPGDEEF2KIDO1 | |
| SCHEMBL14969252 | 0.75 | EEF2K (0.34) | KDM4EALDH1A1HPGDEEF2KIDO1 |
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 |