Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 4/20 | 0.37 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | JAK1 | P23458 | 2/20 | 0.36 |
| ▸ | TYK2 | P29597 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.36 |
| ▸ | BUB1 | O43683 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CDC7 | O00311 | 1/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PRKACA | P17612 | 1/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4335763 | 0.84 | MAPKAPK2 (0.38) | MAPKAPK2JAK2JAK1TYK2HTT | |
| SCHEMBL4342779 | 0.77 | MAPKAPK2 (0.37) | MAPKAPK2JAK2JAK1TYK2HTT | |
| SCHEMBL4351610 | 0.77 | JAK2 (0.41) | MAPKAPK2JAK2JAK1TYK2HTT | |
| Trifluoroacetic Acid SCHEMBL4352730 | 0.74 | MAPKAPK2 (0.38) | MAPKAPK2JAK2JAK1TYK2HTT | |
| SCHEMBL4352734 | 0.74 | MAPKAPK2 (0.36) | MAPKAPK2JAK2JAK1TYK2HTT | |
| SCHEMBL4337024 | 0.70 | BUB1 (0.40) | MAPKAPK2JAK2JAK1TYK2HTT | |
| SCHEMBL4344098 | 0.66 | NAMPT (0.39) | ALDH1A1MAP4K4MAPT | |
| SCHEMBL4338517 | 0.65 | BUB1 (0.41) | MAPKAPK2BUB1MEN1KMT2AALDH1A1 | |
| SCHEMBL17775142 | 0.65 | TSHR (0.37) | MEN1KMT2AALDH1A1SSTR4 | |
| SCHEMBL4347058 | 0.62 | ALDH1A1 (0.42) | HTTALDH1A1MAP4K4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501797-B1 | 3-(SUBSTITUTED AMINO)-1H-INDOLE-2-CARBOXYLIC ACID ESTER AND 3-(SUBSTITUTED AMINO)-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID ESTER DERIVATIVES AS INTERLEUKIN-4 GENE EXPRESSION INHIBITORS | AVENTIS PHARMA INC (US) | 2009-08-05 | — | — | EP | claimed |