Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | CASP4 | P49662 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | CASP9 | P55211 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5564013 | 0.82 | HTT (0.39) | ACHELMNAALDH1A1SMN1; SMN2HTT | |
| SCHEMBL5562474 | 0.81 | ESPL1 (0.40) | ACHELMNASMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL26621510 | 0.81 | L3MBTL1 (0.38) | ACHELMNAALDH1A1SMN1; SMN2HTT | |
| SCHEMBL4507178 | 0.80 | CYP1A2 (0.46) | LMNAALDH1A1L3MBTL1MAPTMEN1 | |
| SCHEMBL2489103 | 0.80 | MPI (0.52) | ACHELMNAALDH1A1L3MBTL1SCN9A | |
| SCHEMBL5555736 | 0.78 | ESPL1 (0.38) | LMNAALDH1A1SMN1; SMN2HTTL3MBTL1 | |
| SCHEMBL4142860 | 0.76 | MAPT (0.49) | LMNAALDH1A1SMN1; SMN2HTTMAPT | |
| SCHEMBL2144620 | 0.76 | CASP1 (0.49) | LMNAALDH1A1SMN1; SMN2GAAL3MBTL1 | |
| SCHEMBL13341368 | 0.76 | SCN9A (0.38) | ACHELMNASCN9AMEN1KMT2A | |
| SCHEMBL31411769 | 0.75 | MAPT (0.40) | ACHELMNAALDH1A1SMN1; SMN2HTT |
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-1756112-A1 | PYRROLOBENZIMIDAZOLONES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS | Boehringer Ingelheim International GmbH (DE) | 2007-02-28 | — | — | EP | disclosed |
| WO-2005111040-A1 | PYRROLOBENZIMIDAZOLONES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2005-11-24 | — | — | WO | disclosed |