Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 3/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.44 |
| ▸ | RELA | Q04206 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8713429 | 0.78 | ALDH1A1 (0.50) | CYP2C9ALDH1A1ALOX15MAPTL3MBTL1 | |
| SCHEMBL15246843 | 0.72 | CYP2C9 (0.44) | CYP2C9ALDH1A1ALOX15MAPTSMN1; SMN2 | |
| SCHEMBL27553134 | 0.71 | CYP2C9 (0.42) | CYP2C9ALDH1A1ALOX15MAPTL3MBTL1 | |
| SCHEMBL11316216 | 0.71 | ALDH1A1 (0.42) | NFKB1NFKB2RELACYP2C9ALDH1A1 | |
| SCHEMBL30175300 | 0.70 | ALDH1A1 (0.54) | CYP2C9ALDH1A1ALOX15MAPTL3MBTL1 | |
| SCHEMBL10457353 | 0.70 | ALDH1A1 (0.54) | CYP2C9ALDH1A1ALOX15MAPTL3MBTL1 | |
| SCHEMBL4109572 | 0.70 | ALDH1A1 (0.54) | CYP2C9ALDH1A1ALOX15MAPTL3MBTL1 | |
| SCHEMBL23064521 | 0.69 | CYP2C9 (0.41) | CYP2C9ALDH1A1ALOX15MAPTL3MBTL1 | |
| Hydrochloric Acid SCHEMBL29705669 | 0.68 | ALDH1A1 (0.52) | CYP2C9ALDH1A1ALOX15MAPTL3MBTL1 | |
| SCHEMBL1925255 | 0.68 | ALDH1A1 (0.52) | CYP2C9ALDH1A1ALOX15MAPTLMNA |
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-1805196-A1 | SUBSTITUTED ADENINES AND THE USE THEREOF | AstraZeneca AB (SE) | 2007-07-11 | — | — | EP | disclosed |
| WO-2006040558-A1 | SUBSTITUTED ADENINES AND THE USE THEREOF | ASTRAZENECA AB (SE) | 2006-04-20 | — | — | WO | disclosed |