Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.53 |
| ▸ | GLA | P06280 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | F7 | P08709 | 2/20 | 0.46 |
| ▸ | F3 | P13726 | 2/20 | 0.46 |
| ▸ | F10 | P00742 | 1/20 | 0.46 |
| ▸ | PIP4K2A | P48426 | 2/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6072774 | 0.85 | ALDH1A1 (0.54) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL5138971 | 0.80 | PIP4K2A (0.58) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL6222236 | 0.78 | SMN1; SMN2 (0.50) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL6223236 | 0.77 | ADORA1 (0.50) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL6250192 | 0.71 | KDM4E (0.69) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL7018457 | 0.71 | ALDH1A1 (0.64) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL7024723 | 0.71 | ALDH1A1 (0.67) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL6072338 | 0.70 | KDM4E (0.62) | KDM4EALDH1A1GAAHPGDHSD17B10 | |
| SCHEMBL28746020 | 0.70 | RXFP1 (0.67) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL7018672 | 0.70 | ALDH1A1 (0.72) | KDM4EALDH1A1GAAHPGDGLA |
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 |
|---|---|---|---|---|---|---|---|
| US-7432279-B2 | 4,6-diamino-[1,7]naphthyridine-3-carbonitrile inhibitors of Tpl2 kinase and methods of making and using the same | WYETH (US) | 2008-10-07 | — | — | US | disclosed |