Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 5/20 | 0.41 |
| ▸ | GBA1 | P04062 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | PARG | Q86W56 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL5382919 | 0.90 | ALDH1A1 (0.38) | ALDH1A1MEN1KMT2APOLBNPY5R | |
| SCHEMBL5131843 | 0.90 | ALDH1A1 (0.38) | ALDH1A1MEN1KMT2APOLBNPY5R | |
| SCHEMBL12313412 | 0.86 | NPY5R (0.41) | ALDH1A1MEN1KMT2APOLBNPY5R | |
| SCHEMBL5382485 | 0.84 | TDP1 (0.43) | ALDH1A1MEN1KMT2APOLBNPY5R | |
| SCHEMBL7470115 | 0.80 | NPY5R (0.34) | ALDH1A1MEN1KMT2APOLBNPY5R | |
| SCHEMBL5387500 | 0.80 | NPY5R (0.42) | ALDH1A1MEN1KMT2APOLBNPY5R | |
| SCHEMBL5387497 | 0.80 | NPY5R (0.42) | ALDH1A1MEN1KMT2APOLBNPY5R | |
| SCHEMBL1594484 | 0.78 | NPY5R (0.45) | ALDH1A1MEN1KMT2APOLBNPY5R | |
| SCHEMBL2841819 | 0.73 | — | — | |
| SCHEMBL26697611 | 0.71 | GBA1 (0.44) | ALDH1A1MEN1KMT2ANPY5RGBA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1797078-A4 | COMPOUNDS, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF III | ASTRAZENECA AB (SE) | 2009-04-01 | — | — | EP | claimed |
| EP-1797078-A1 | COMPOUNDS, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF III | AstraZeneca AB (SE) | 2007-06-20 | — | — | EP | claimed |
| WO-2006033630-A1 | COMPOUNDS, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF III | ASTRAZENECA AB (SE) | 2006-03-30 | — | — | WO | claimed |