Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 2/20 | 0.36 |
| ▸ | ACAT2 | Q9BWD1 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14398521 | 0.86 | KDM4E (0.33) | KDM4EMAPTNPC1GAAMAPK1 | |
| SCHEMBL14398528 | 0.86 | ALDH1A1 (0.34) | KDM4EMAPTNPC1GAAMAPK1 | |
| SCHEMBL17757586 | 0.83 | PDE7A (0.37) | PDE7AACAT2KDM4EMAPT | |
| SCHEMBL17757587 | 0.80 | VNN1 (0.33) | PDE7AACAT2MAPT | |
| SCHEMBL17758099 | 0.77 | ACAT2 (0.37) | ACAT2KDM4EMAPTGAARAB9A | |
| SCHEMBL20586945 | 0.77 | HTR5A (0.36) | PDE7AACAT2KDM4EMAPTNPC1 | |
| SCHEMBL17757644 | 0.76 | CYP2D6 (0.39) | PDE7AACAT2KDM4EMAPTNPC1 | |
| SCHEMBL14398518 | 0.76 | KMT2A (0.41) | PDE7AACAT2KDM4EMAPTNPC1 | |
| SCHEMBL17757653 | 0.76 | KMT2A (0.41) | PDE7AACAT2KDM4EMAPTNPC1 | |
| SCHEMBL17757467 | 0.76 | KMT2A (0.41) | PDE7AACAT2KDM4EMAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007117180-A1 | AZAHETEROCYCLES, COMBINATORY LIBRARY, FOCUSED LIBRARY, PHARMACEUTICAL COMPOSITION AND METHODS FOR THE PRODUCTION THEREOF | 'CHEMICAL DIVERSITY RESEARCH INSTITUTE' LTD. (RU) | 2007-10-18 | — | — | WO | disclosed |