Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 3/20 | 0.60 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.59 |
| ▸ | NAMPT | P43490 | 1/20 | 0.57 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.56 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.54 |
| ▸ | PPARG | P37231 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7908588 | 0.90 | KCNQ2 (0.57) | MGLLKCNQ2NAMPTROCK2ENPP2 | |
| SCHEMBL5202815 | 0.86 | KCNQ2 (0.61) | MGLLKCNQ2NAMPTROCK2ENPP2 | |
| SCHEMBL8985906 | 0.84 | SRD5A2 (0.60) | MGLLROCK2ENPP2TP53MAPT | |
| SCHEMBL5272080 | 0.84 | KCNQ2 (0.60) | MGLLKCNQ2NAMPTPPARGMAPT | |
| SCHEMBL2971216 | 0.81 | KIT (0.57) | MGLLROCK2ENPP2POLBADORA3 | |
| SCHEMBL8985820 | 0.80 | MMP13 (0.68) | MGLLKCNQ2NAMPTROCK2TP53 | |
| SCHEMBL5210856 | 0.80 | KCNQ2 (0.55) | KCNQ2NAMPTPPARGMAPTNPC1 | |
| SCHEMBL15060321 | 0.78 | NAMPT (0.59) | KCNQ2NAMPTROCK2PPARGTP53 | |
| SCHEMBL30207797 | 0.78 | MGLL (0.65) | MGLLROCK2ENPP2TP53MAPT | |
| SCHEMBL4432278 | 0.78 | MGLL (0.65) | MGLLROCK2ENPP2TP53MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1831218-A2 | CARBAMATE SUBSTITUTED IMIDAZO- AND PYRROLO-PYRIDINES AS PROTEIN KINASE INHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2007-09-12 | — | — | EP | disclosed |
| WO-2006066914-A2 | CARBAMATE SUBSTITUTED IMIDAZO- AND PYRROLO-PYRIDINES AS PROTEIN KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-06-29 | — | — | WO | disclosed |