Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | MITF | O75030 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | ACHE | P22303 | 2/20 | 0.52 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | HTR7 | P34969 | 1/20 | 0.51 |
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
| ▸ | HTR5A | P47898 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8324389 | 0.82 | HTR7 (0.58) | ALDH1A1KDM4EMITFHTTACHE | |
| SCHEMBL186570 | 0.82 | HTT (0.50) | ALDH1A1KDM4EMITFHTT | |
| SCHEMBL29442867 | 0.82 | HTT (0.50) | ALDH1A1KDM4EMITFHTT | |
| SCHEMBL2759522 | 0.80 | HTT (0.51) | ALDH1A1KDM4EMITFHTT | |
| SCHEMBL3436226 | 0.79 | HTT (0.52) | ALDH1A1KDM4EMITFHTTACHE | |
| SCHEMBL16180726 | 0.79 | ACHE (0.56) | ACHEHTR1AHTR2CHTR7HTR2B | |
| SCHEMBL14340525 | 0.79 | KDM4E (0.52) | ALDH1A1KDM4EMITFHTTACHE | |
| Ammonia Solution, Strong SCHEMBL23291273 | 0.78 | HTT (0.50) | ALDH1A1KDM4EMITFHTT | |
| SCHEMBL14924466 | 0.77 | HTR7 (0.52) | ALDH1A1ACHEHTR1AHTR2CHTR7 | |
| SCHEMBL19936609 | 0.77 | KDM4E (0.50) | ALDH1A1KDM4EMITFHTTACHE |
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-1592426-B1 | 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF | NOVARTIS AG (CH) | 2007-12-19 | — | — | EP | disclosed |
| WO-2004069256-A1 | 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF | NOVARTIS AG (CH) | 2004-08-19 | — | — | WO | disclosed |